Vitas-M small molecule compound
ethyl 6-ethyl-2-{[(4-methylphenyl)carbonyl]amino}-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate
Catalog ID
STK442086
SMILES CCOC(=O)c1c(NC(=O)c2ccc(cc2)C)sc2c1CCC(C2)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 C21H25NO3S MW 371.50 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H25NO3S/c1-4-14-8-11-16-17(12-14)26-20(18(16)21(24)25-5-2)22-19(23)15-9-6-13(3)7-10-15/h6-7,9-10,14H,4-5,8,11-12H2,1-3H3,(H,22,23)InChIKey
ZEKQYEDVASHFMD-UHFFFAOYSA-NSynonyms
CCC1CCC2=C(C1)SC(=C2C(=O)OCC)NC(=O)C3=CC=C(C=C3)C
ethyl6ethyl2(((4methylphenyl)carbonyl)amino)4567tetrahydro1benzothiophene3carboxylate
ethyl6ethyl2((4methylbenzoyl)amino)4567tetrahydro1benzothiophene3carboxylate
InChI=1SC21H25NO3Sc14148111617(1214)2620(18(16)21(24)2552)2219(23)159613(3)71015h6791014H4581112H213H3(H2223)
MFCD01344070
ZINC000001102490
ZINC000001102491
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