RInChI=1.00.1S/C16H21BrN4O2/c1-15(2)12(4-5-16(15,3)23)20-13-10(14(18)22)7-19-21-8-9(17)6-11(13)21/h6-8,12,20,23H,4-5H2,1-3H3,(H2,18,22)<>C8H17NO/c1-7(2)6(9)4-5-8(7,3)10/h6,10H,4-5,9H2,1-3H3!C8H19N/c1-6-9(7(2)3)8(4)5/h7-8H,6H2,1-5H3!C8H5BrClN3O/c9-4-1-6-7(10)5(8(11)14)2-12-13(6)3-4/h1-3H,(H2,11,14)<>C2H3N/c1-2-3/h1H3/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/E:(1,2)/rA:23CCCCCCCCCCCCCCCCBrNNNNOO/rB:;;;s4;;;;s6d8;s7;d6;s4;d10s11;s10;s1s2s12;s3s5s15;s9;d14;d7;s12s13;s8s11s19;s14;s16;/rC:;;;;;;;;;;;;;;;;;;;;;;;<>0/N:1,2,3,4,5,6,7,8,9,10/E:(1,2)/rA:10CCCCCCCCNO/rB:;;;s4;s4;s1s2s6;s3s5s7;s6;s8;/rC:;;;;;;;;;;!0/N:1,2,3,4,5,6,7,8,9/E:(2,3,4,5)(7,8)/rA:9CCCCCCCCN/rB:;;;;s1;s2s3;s4s5;s6s7s8;/rC:;;;;;;;;;!1/N:1,2,3,4,5,6,7,8,9,10,11,12,13,14/rA:14CCCCCCCCBrClNNNO/rB:;;s1d3;s2;d1;d5s6;s5;s4;s7;d8;d2;s3s6s12;s8;/rC:;;;;;;;;;;;;;;<>0/N:1,2,3/rA:3CCN/rB:s1;t2;/rC:;;;
Long-RInChIKey=SA-BUHFF-VDLPLNCPVVIAPW-UHFFFAOYSA-N--UYTJNDRRIWOMIR-UHFFFAOYSA-N-JGFZNNIVVJXRND-UHFFFAOYSA-N-CPJUWOTXCPVZOC-UHFFFAOYSA-N--WEVYAHXRMPXWCK-UHFFFAOYSA-N
Short-RInChIKey=SA-BUHFF-VDLPLNCPVV-DJQKROMYLW-WEVYAHXRMP-NUHFF-NUHFF-NUHFF-ZZZ
Web-RInChIKey=GPQUODDESNATNUFAX-NUHFFFADPSCTJSA