Vitas-M small molecule compound
2-[(5-butyl-5H-[1,2,4]triazino[5,6-b]indol-3-yl)sulfanyl]-N-[5-(4-methylphenyl)-6H-1,3,4-thiadiazin-2-yl]butanamide
Catalog ID
STK215914
SMILES CCCCn1c2ccccc2c2c1nc(nn2)SC(C(=O)NC1=NN=C(CS1)c1ccc(cc1)C)CC
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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 C27H29N7OS2 MW 531.71 g/mol Purity >90% as per NMR
InChI
InChI=1S/C27H29N7OS2/c1-4-6-15-34-21-10-8-7-9-19(21)23-24(34)28-27(33-31-23)37-22(5-2)25(35)29-26-32-30-20(16-36-26)18-13-11-17(3)12-14-18/h7-14,22H,4-6,15-16H2,1-3H3,(H,29,32,35)InChIKey
WDFLRRHAMIMJBS-UHFFFAOYSA-NSynonyms
878991-01-62((5BUTYL(124)TRIAZINO(56B)INDOL3YL)SULFANYL)N(5(4METHYLPHENYL)6H134THIADIAZIN2YL)BUTANAMIDE
2((5BUTYL5H(124)TRIAZINO(56B)INDOL3YL)SULFANYL)N(5(4METHYLPHENYL)6H134THIADIAZIN2YL)BUTANAMIDE
878991016
CCCCN1C2=CC=CC=C2C3=C1N=C(N=N3)SC(CC)C(=O)NC4=NN=C(CS4)C5=CC=C(C=C5)C
InChI=1SC27H29N7OS2c1461534211087919(21)2324(34)2827(333123)3722(52)25(35)2926323020(163626)18131117(3)121418h71422H461516H213H3(H293235)
MFCD08554951
ZINC000097995363
ZINC000097995364
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