Vitas-M small molecule compound
2-({[(4,5-dimethyl-4H-1,2,4-triazol-3-yl)sulfanyl]acetyl}amino)-6-methyl-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxamide
Catalog ID
STK489125
SMILES CC1CCc2c(C1)sc(c2C(=O)N)NC(=O)CSc1nnc(n1C)C
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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 C16H21N5O2S2 MW 379.51 g/mol Purity >90% as per NMR
InChI
InChI=1S/C16H21N5O2S2/c1-8-4-5-10-11(6-8)25-15(13(10)14(17)23)18-12(22)7-24-16-20-19-9(2)21(16)3/h8H,4-7H2,1-3H3,(H2,17,23)(H,18,22)InChIKey
CHKJFGFFEBMYPT-UHFFFAOYSA-NSynonyms
2((((45dimethyl4H124triazol3yl)sulfanyl)acetyl)amino)6methyl4567tetrahydro1benzothiophene3carboxamide
2((2((45dimethyl124triazol3yl)sulfanyl)acetyl)amino)6methyl4567tetrahydro1benzothiophene3carboxamide
CC1CCC2=C(C1)SC(=C2C(=O)N)NC(=O)CSC3=NN=C(N3C)C
InChI=1SC16H21N5O2S2c18451011(68)2515(13(10)14(17)23)1812(22)7241620199(2)21(16)3h8H47H213H3(H21723)(H1822)
MFCD05124327
ZINC000013746176
ZINC000013746179
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