Vitas-M small molecule compound
2-({[(5-ethyl-4-methyl-4H-1,2,4-triazol-3-yl)sulfanyl]acetyl}amino)-6-methyl-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxamide
Catalog ID
STK463479
SMILES CCc1nnc(n1C)SCC(=O)Nc1sc2c(c1C(=O)N)CCC(C2)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 C17H23N5O2S2 MW 393.53 g/mol Purity >90% as per NMR
InChI
InChI=1S/C17H23N5O2S2/c1-4-12-20-21-17(22(12)3)25-8-13(23)19-16-14(15(18)24)10-6-5-9(2)7-11(10)26-16/h9H,4-8H2,1-3H3,(H2,18,24)(H,19,23)InChIKey
PIQDANFMKSINCU-UHFFFAOYSA-NSynonyms
2((((5ethyl4methyl4H124triazol3yl)sulfanyl)acetyl)amino)6methyl4567tetrahydro1benzothiophene3carboxamide
2((2((5ethyl4methyl124triazol3yl)sulfanyl)acetyl)amino)6methyl4567tetrahydro1benzothiophene3carboxamide
CCC1=NN=C(N1C)SCC(=O)NC2=C(C3=C(S2)CC(CC3)C)C(=O)N
InChI=1SC17H23N5O2S2c1412202117(22(12)3)25813(23)191614(15(18)24)10659(2)711(10)2616h9H48H213H3(H21824)(H1923)
MFCD05080788
ZINC000017080437
ZINC000017080438
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