Vitas-M small molecule compound

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

Catalog ID
STK099951
SMILES CCOC(=O)c1c(sc(c1C)C(=O)Nc1ccc(cc1)OC)NC(=O)c1ccc(cc1)Cl

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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 C23H21ClN2O5S MW 472.95 g/mol Purity >90% as per NMR
InChI
InChI=1S/C23H21ClN2O5S/c1-4-31-23(29)18-13(2)19(21(28)25-16-9-11-17(30-3)12-10-16)32-22(18)26-20(27)14-5-7-15(24)8-6-14/h5-12H,4H2,1-3H3,(H,25,28)(H,26,27)
InChIKey
SHDPTGCYLQYWHW-UHFFFAOYSA-N
Synonyms

CCOC(=O)C1=C(SC(=C1C)C(=O)NC2=CC=C(C=C2)OC)NC(=O)C3=CC=C(C=C3)Cl
CCOC(=O)c1c(sc(c1C)C(=O)Nc1ccc(cc1)OC)NC(=O)c1ccc(cc1)Cl
ETHYL2(((4CHLOROPHENYL)CARBONYL)AMINO)5((4METHOXYPHENYL)CARBAMOYL)4METHYLTHIOPHENE3CARBOXYLATE
ETHYL2((4CHLOROBENZOYL)AMINO)5((4METHOXYPHENYL)CARBAMOYL)4METHYLTHIOPHENE3CARBOXYLATE
ETHYL2((4CHLOROPHENYL)CARBONYLAMINO)5(N(4METHOXYPHENYL)CARBAMOYL)4METHYLTHIOPHENE3CARBOXYLATE
InChI=1SC23H21ClN2O5Sc143123(29)1813(2)19(21(28)251691117(303)121016)3222(18)2620(27)145715(24)8614h512H4H213H3(H2528)(H2627)
MFCD01151697
STK099951
ZINC000002758231
ZINC02758231
ZINC2758231

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Available files

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