Vitas-M small molecule compound
N,N'-(4-methylbenzene-1,3-diyl)bis{2-[(5-methyl-5H-[1,2,4]triazino[5,6-b]indol-3-yl)sulfanyl]acetamide}
Catalog ID
STK673388
SMILES O=C(Nc1ccc(c(c1)NC(=O)CSc1nnc2c(n1)n(C)c1c2cccc1)C)CSc1nnc2c(n1)n(C)c1c2cccc1
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We supply compounds in quantities from 1 mg up to 5 g for research and development purposes only.
We do not supply quantities above 5 g.
Structure and other identifiers
2D representation rendered from the SMILES, with core physicochemical data.Formula C31H26N10O2S2 MW 634.75 g/mol Purity >90% as per NMR
InChI
InChI=1S/C31H26N10O2S2/c1-17-12-13-18(32-24(42)15-44-30-34-28-26(36-38-30)19-8-4-6-10-22(19)40(28)2)14-21(17)33-25(43)16-45-31-35-29-27(37-39-31)20-9-5-7-11-23(20)41(29)3/h4-14H,15-16H2,1-3H3,(H,32,42)(H,33,43)InChIKey
XZRSGQKAXYUYNH-UHFFFAOYSA-NSynonyms
CC1=C(C=C(C=C1)NC(=O)CSC2=NC3=C(C4=CC=CC=C4N3C)N=N2)NC(=O)CSC5=NC6=C(C7=CC=CC=C7N6C)N=N5
InChI=1SC31H26N10O2S2c117121318(3224(42)154430342826(363830)198461022(19)40(28)2)1421(17)3325(43)164531352927(373931)209571123(20)41(29)3h414H1516H213H3(H3242)(H3343)
MFCD01304644
N(4METHYL3((2((5METHYL(124)TRIAZINO(56B)INDOL3YL)SULFANYL)ACETYL)AMINO)PHENYL)2((5METHYL(124)TRIAZINO(56B)INDOL3YL)SULFANYL)ACETAMIDE
NN(4methylbenzene13diyl)bis(2((5methyl5H(124)triazino(56b)indol3yl)sulfanyl)acetamide)
ZINC000033355207
ZINC33355207
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