Vitas-M small molecule compound
N-(6-tert-butyl-3-cyano-4,5,6,7-tetrahydro-1-benzothiophen-2-yl)-2-{[5-(2-hydroxyphenyl)-4-(prop-2-en-1-yl)-4H-1,2,4-triazol-3-yl]sulfanyl}acetamide
Catalog ID
STL297347
SMILES C=CCn1c(SCC(=O)Nc2sc3c(c2C#N)CCC(C3)C(C)(C)C)nnc1c1ccccc1O
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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 C26H29N5O2S2 MW 507.68 g/mol Purity >90% as per NMR
InChI
InChI=1S/C26H29N5O2S2/c1-5-12-31-23(18-8-6-7-9-20(18)32)29-30-25(31)34-15-22(33)28-24-19(14-27)17-11-10-16(26(2,3)4)13-21(17)35-24/h5-9,16,32H,1,10-13,15H2,2-4H3,(H,28,33)InChIKey
OVTWRQOJDCEIJM-UHFFFAOYSA-NSynonyms
MFCD05991319
N(6tertbutyl3cyano4567tetrahydro1benzothiophen2yl)2((5(2hydroxyphenyl)4(prop2en1yl)4H124triazol3yl)sulfanyl)acetamide
ZINC000002857719
ZINC000002857720
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