Vitas-M small molecule compound

ethyl 5-[(3-chloro-2-methylphenyl)carbamoyl]-2-[(cyclohexylcarbonyl)amino]-4-methylthiophene-3-carboxylate

Catalog ID
STK078975
SMILES CCOC(=O)c1c(NC(=O)C2CCCCC2)sc(c1C)C(=O)Nc1cccc(c1C)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 C23H27ClN2O4S MW 463.00 g/mol Purity >90% as per NMR
InChI
InChI=1S/C23H27ClN2O4S/c1-4-30-23(29)18-14(3)19(21(28)25-17-12-8-11-16(24)13(17)2)31-22(18)26-20(27)15-9-6-5-7-10-15/h8,11-12,15H,4-7,9-10H2,1-3H3,(H,25,28)(H,26,27)
InChIKey
FPLIMWNLKRZNSL-UHFFFAOYSA-N
Synonyms

CCOC(=O)C1=C(SC(=C1C)C(=O)NC2=C(C(=CC=C2)Cl)C)NC(=O)C3CCCCC3
CCOC(=O)c1c(NC(=O)C2CCCCC2)sc(c1C)C(=O)Nc1cccc(c1C)Cl
ETHYL5((3CHLORO2METHYLPHENYL)CARBAMOYL)2((CYCLOHEXYLCARBONYL)AMINO)4METHYLTHIOPHENE3CARBOXYLATE
ETHYL5((3CHLORO2METHYLPHENYL)CARBAMOYL)2(CYCLOHEXANECARBONYLAMINO)4METHYLTHIOPHENE3CARBOXYLATE
ETHYL5(N(3CHLORO2METHYLPHENYL)CARBAMOYL)2(CYCLOHEXYLCARBONYLAMINO)4METHYLTHIOPHENE3CARBOXYLATE
InChI=1SC23H27ClN2O4Sc143023(29)1814(3)19(21(28)25171281116(24)13(17)2)3122(18)2620(27)1596571015h8111215H47910H213H3(H2528)(H2627)
MFCD02627395
STK078975
ZINC000006547891
ZINC06547891
ZINC6547891

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Available files

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