RInChI=1.00.1S/C18H17BrN4O/c1-11-7-16(22-18-6-3-13(9-20)10-21-18)15-8-14(19)4-5-17(15)23(11)12(2)24/h3-6,8,10-11,16H,7H2,1-2H3,(H,21,22)!C5H10Si/c1-5-6(2,3)4/h1H,2-4H3!C6H15N/c1-4-7(5-2)6-3/h4-6H2,1-3H3<>C23H26N4OSi/c1-16-12-21(26-23-9-7-19(14-24)15-25-23)20-13-18(10-11-29(3,4)5)6-8-22(20)27(16)17(2)28/h6-9,13,15-16,21H,12H2,1-5H3,(H,25,26)<>2C18H15P.2ClH.Pd/c2*1-4-10-16(11-5-1)19(17-12-6-2-7-13-17)18-14-8-3-9-15-18;;;/h2*1-15H;2*1H;/q;;;;+2/p-2!C3H7NO/c1-4(2)3-5/h3H,1-2H3!Cu.HI/h;1H/q+1;/p-1/d+
RAuxInfo=1.00.1/1/N:1,2,3,4,5,6,7,8,9,10,11,12,13,14,15,16,17,18,19,20,21,22,23,24/rA:24CCCCCCCCCCCCCCCCCCBrNNNNO/rB:;;;d4;d3;;;;;s1s7;s2;s3s9d10;s4d8;s8;s7s15;s5d15;s6;s14;t9;s10s18;s16d18;s11s12s17;d12;/rC:;;;;;;;;;;;;;;;;;;;;;;;;!0/N:1,2,3,4,5,6/E:(2,3,4)/rA:6CCCCCSi/rB:;;;t1;s2s3s4s5;/rC:;;;;;;!0/N:1,2,3,4,5,6,7/E:(1,2,3)(4,5,6)/rA:7CCCCCCN/rB:;;s1;s2;s3;s4s5s6;/rC:;;;;;;;<>1/N:1,2,3,4,5,6,7,8,9,10,11,12,13,14,15,16,17,18,19,20,21,22,23,24,25,26,27,28,29/E:(3,4,5)/rA:29CCCCCCCCCCCCCCCCCCCCCCCNNNNOSi/rB:;;;;;;d6;d7;;t10;;;;;s1s12;s2;s6s10d13;s7s14d15;s13;s12s20;s8d20;s9;t14;s15s23;s21d23;s16s17s22;d17;s3s4s5s11;/rC:;;;;;;;;;;;;;;;;;;;;;;;;;;;;;<>1/N:1,2,3,4,5,6,7,8,9,10,11,12,13,14,15,16,17,18,19;20,21,22,23,24,25,26,27,28,29,30,31,32,33,34,35,36,37,38;39;40;41/E:2*(1,2,3)(4,5,6,7,8,9)(10,11,12,13,14,15)(16,17,18);;;/rA:41CCCCCCCCCCCCCCCCCCPCCCCCCCCCCCCCCCCCCPCl-Cl-Pd+2/rB:;;d1;s1;d2;s2;d3;s3;s4;d5;s6;d7;s8;d9;d10s11;d12s13;d14s15;s16s17s18;;;;d20;s20;d21;s21;d22;s22;s23;d24;s25;d26;s27;d28;d29s30;d31s32;d33s34;s35s36s37;;;;/rC:;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;!0/N:1,2,3,4,5/E:(1,2)/rA:5CCCNO/rB:;;s1s2s3;d3;/rC:;;;;;!1/N:1;2/rA:2Cu+I-/rB:;/rC:;;
Long-RInChIKey=SA-FUHFF-MPAQZIQPIDOTNH-UHFFFAOYSA-N-CWMFRHBXRUITQE-UHFFFAOYSA-N-ZMANZCXQSJIPKH-UHFFFAOYSA-N--GIPZSIVXHAGELR-UHFFFAOYSA-N--YNHIGQDRGKUECZ-UHFFFAOYSA-L-ZMXDDKWLCZADIW-UHFFFAOYSA-N-LSXDOTMGLUJQCM-UHFFFAOYSA-M
Short-RInChIKey=SA-FUHFF-WKUDFKXDAP-GIPZSIVXHA-UPLWWIPNPS-NUHFF-NUHFF-KUHFF-ZZZ
Web-RInChIKey=QHWRQYHDSNFNSCRYH-KUHFFFADPSCTJSA