Vitas-M small molecule compound
N-(3-cyano-4,5,6,7-tetrahydro-1-benzothiophen-2-yl)-2-[(5-methyl-5H-[1,2,4]triazino[5,6-b]indol-3-yl)sulfanyl]acetamide
Catalog ID
STK120717
SMILES N#Cc1c(NC(=O)CSc2nnc3c(n2)n(C)c2c3cccc2)sc2c1CCCC2
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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 C21H18N6OS2 MW 434.55 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H18N6OS2/c1-27-15-8-4-2-7-13(15)18-19(27)24-21(26-25-18)29-11-17(28)23-20-14(10-22)12-6-3-5-9-16(12)30-20/h2,4,7-8H,3,5-6,9,11H2,1H3,(H,23,28)InChIKey
ICOABJSDPWYYNG-UHFFFAOYSA-NSynonyms
330555-34-5330555345
CN1C2=CC=CC=C2C3=C1N=C(N=N3)SCC(=O)NC4=C(C5=C(S4)CCCC5)C#N
InChI=1SC21H18N6OS2c12715842713(15)1819(27)2421(262518)291117(28)232014(1022)12635916(12)3020h2478H356911H21H3(H2328)
MFCD00826958
N(3cyano4567tetrahydro1benzothiophen2yl)2((5methyl(124)triazino(56b)indol3yl)sulfanyl)acetamide
N(3cyano4567tetrahydro1benzothiophen2yl)2((5methyl5H(124)triazino(56b)indol3yl)sulfanyl)acetamide
ZINC000002187925
ZINC02187925
ZINC2187925
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