Vitas-M small molecule compound
ethyl 2-{[(2,4-dimethoxyphenyl)carbonyl]amino}-6-methyl-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate
Catalog ID
STK426437
SMILES CCOC(=O)c1c(NC(=O)c2ccc(cc2OC)OC)sc2c1CCC(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 C21H25NO5S MW 403.50 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H25NO5S/c1-5-27-21(24)18-15-8-6-12(2)10-17(15)28-20(18)22-19(23)14-9-7-13(25-3)11-16(14)26-4/h7,9,11-12H,5-6,8,10H2,1-4H3,(H,22,23)InChIKey
KYKBWXSZENANDU-UHFFFAOYSA-NSynonyms
CCOC(=O)C1=C(SC2=C1CCC(C2)C)NC(=O)C3=C(C=C(C=C3)OC)OC
ethyl2(((24dimethoxyphenyl)carbonyl)amino)6methyl4567tetrahydro1benzothiophene3carboxylate
ethyl2((24dimethoxybenzoyl)amino)6methyl4567tetrahydro1benzothiophene3carboxylate
InChI=1SC21H25NO5Sc152721(24)18158612(2)1017(15)2820(18)2219(23)149713(253)1116(14)264h791112H56810H214H3(H2223)
MFCD01344258
ZINC000002736827
ZINC000002736828
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