Vitas-M small molecule compound
methyl 2-{[(2,3-dimethoxyphenyl)carbonyl]amino}-6-ethyl-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate
Catalog ID
STK452811
SMILES CCC1CCc2c(C1)sc(c2C(=O)OC)NC(=O)c1cccc(c1OC)OC
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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/c1-5-12-9-10-13-16(11-12)28-20(17(13)21(24)27-4)22-19(23)14-7-6-8-15(25-2)18(14)26-3/h6-8,12H,5,9-11H2,1-4H3,(H,22,23)InChIKey
ZKOLTBOVRLFQNJ-UHFFFAOYSA-NSynonyms
CCC1CCC2=C(C1)SC(=C2C(=O)OC)NC(=O)C3=C(C(=CC=C3)OC)OC
InChI=1SC21H25NO5Sc15129101316(1112)2820(17(13)21(24)274)2219(23)1476815(252)18(14)263h6812H5911H214H3(H2223)
methyl2(((23dimethoxyphenyl)carbonyl)amino)6ethyl4567tetrahydro1benzothiophene3carboxylate
methyl2((23dimethoxybenzoyl)amino)6ethyl4567tetrahydro1benzothiophene3carboxylate
MFCD02372530
ZINC000000679961
ZINC000000679962
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