Vitas-M small molecule compound

ethyl 5-[(3-chloro-4-methylphenyl)carbamoyl]-4-methyl-2-{[(3-methylphenyl)carbonyl]amino}thiophene-3-carboxylate

Catalog ID
STK002483
SMILES CCOC(=O)c1c(NC(=O)c2cccc(c2)C)sc(c1C)C(=O)Nc1ccc(c(c1)Cl)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 C24H23ClN2O4S MW 470.98 g/mol Purity >90% as per NMR
InChI
InChI=1S/C24H23ClN2O4S/c1-5-31-24(30)19-15(4)20(22(29)26-17-10-9-14(3)18(25)12-17)32-23(19)27-21(28)16-8-6-7-13(2)11-16/h6-12H,5H2,1-4H3,(H,26,29)(H,27,28)
InChIKey
DQNZUGUDSGBFLU-UHFFFAOYSA-N
Synonyms

CCOC(=O)C1=C(SC(=C1C)C(=O)NC2=CC(=C(C=C2)C)Cl)NC(=O)C3=CC(=CC=C3)C
CCOC(=O)c1c(NC(=O)c2cccc(c2)C)sc(c1C)C(=O)Nc1ccc(c(c1)Cl)C
ETHYL5((3CHLORO4METHYLPHENYL)CARBAMOYL)4METHYL2(((3METHYLPHENYL)CARBONYL)AMINO)THIOPHENE3CARBOXYLATE
ETHYL5((3CHLORO4METHYLPHENYL)CARBAMOYL)4METHYL2((3METHYLBENZOYL)AMINO)THIOPHENE3CARBOXYLATE
ETHYL5(N(3CHLORO4METHYLPHENYL)CARBAMOYL)4METHYL2((3METHYLPHENYL)CARBONYLAMINO)THIOPHENE3CARBOXYLATE
InChI=1SC24H23ClN2O4Sc153124(30)1915(4)20(22(29)261710914(3)18(25)1217)3223(19)2721(28)1686713(2)1116h612H5H214H3(H2629)(H2728)
MFCD02627397
STK002483
ZINC000002731690
ZINC02731690
ZINC2731690

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Available files

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