Vitas-M small molecule compound

ethyl 2-{[(5-chloro-2-methoxyphenyl)carbonyl]amino}-5-(dimethylcarbamoyl)-4-methylthiophene-3-carboxylate

Catalog ID
STK435399
SMILES CCOC(=O)c1c(NC(=O)c2cc(Cl)ccc2OC)sc(c1C)C(=O)N(C)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 C19H21ClN2O5S MW 424.90 g/mol Purity >90% as per NMR
InChI
InChI=1S/C19H21ClN2O5S/c1-6-27-19(25)14-10(2)15(18(24)22(3)4)28-17(14)21-16(23)12-9-11(20)7-8-13(12)26-5/h7-9H,6H2,1-5H3,(H,21,23)
InChIKey
XNCYFHVYLCUSCO-UHFFFAOYSA-N
Synonyms

CCOC(=O)C1=C(SC(=C1C)C(=O)N(C)C)NC(=O)C2=C(C=CC(=C2)Cl)OC
ethyl2(((5chloro2methoxyphenyl)carbonyl)amino)5(dimethylcarbamoyl)4methylthiophene3carboxylate
ETHYL2((5CHLORO2METHOXYBENZOYL)AMINO)5((DIMETHYLAMINO)CARBONYL)4METHYL3THIOPHENECARBOXYLATE
ETHYL2((5CHLORO2METHOXYBENZOYL)AMINO)5(DIMETHYLCARBAMOYL)4METHYLTHIOPHENE3CARBOXYLATE
ETHYL5(NNDIMETHYLCARBAMOYL)2((5CHLORO2METHOXYPHENYL)CARBONYLAMINO)4METHYLTHIOPHENE3CARBOXYLATE
InChI=1SC19H21ClN2O5Sc162719(25)1410(2)15(18(24)22(3)4)2817(14)2116(23)12911(20)7813(12)265h79H6H215H3(H2123)
MFCD03396797
ZINC000000656971
ZINC00656971
ZINC656971

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Available files

Download the SDF, MOL, 3D structure and SDS documents from Vitas-M.