RInChI=1.00.1S/C16H22BrN5O/c1-15(2)12(4-5-16(15,3)19)21-13-10(14(18)23)7-20-22-8-9(17)6-11(13)22/h6-8,12,21H,4-5,19H2,1-3H3,(H2,18,23)<>C8H18N2/c1-7(2)6(9)4-5-8(7,3)10/h6H,4-5,9-10H2,1-3H3!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)!CH2Cl2.CH4O/c2-1-3;1-2/h1H2;2H,1H3<>C3H7NO/c1-4(2)3-5/h3H,1-2H3/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:23CCCCCCCCCCCCCCCCBrNNNNNO/rB:;;;s4;;;;s6d8;s7;d6;s4;d10s11;s10;s1s2s12;s3s5s15;s9;d14;s16;d7;s12s13;s8s11s20;s14;/rC:;;;;;;;;;;;;;;;;;;;;;;;<>0/N:1,2,3,4,5,6,7,8,9,10/E:(1,2)/rA:10CCCCCCCCNN/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;4,5/E:(2,3);/rA:5CClClCO/rB:s1;s1;;s4;/rC:;;;;;<>0/N:1,2,3,4,5/E:(1,2)/rA:5CCCNO/rB:;;s1s2s3;d3;/rC:;;;;;
Long-RInChIKey=SA-BUHFF-ODFYUHALLJBYQN-UHFFFAOYSA-N--XBFJECMZLDVTML-UHFFFAOYSA-N-JGFZNNIVVJXRND-UHFFFAOYSA-N-CPJUWOTXCPVZOC-UHFFFAOYSA-N-WGLUMOCWFMKWIL-UHFFFAOYSA-N--ZMXDDKWLCZADIW-UHFFFAOYSA-N
Short-RInChIKey=SA-BUHFF-ODFYUHALLJ-CRXKISPNIZ-ZMXDDKWLCZ-NUHFF-NUHFF-NUHFF-ZZZ
Web-RInChIKey=BJMIZGFILIXWODQEB-NUHFFFADPSCTJSA