Vitas-M small molecule compound

propan-2-yl 2-{[(2,6-difluorophenyl)carbonyl]amino}-4-methyl-5-[(4-methylphenyl)carbamoyl]thiophene-3-carboxylate

Catalog ID
STK451313
SMILES CC(OC(=O)c1c(sc(c1C)C(=O)Nc1ccc(cc1)C)NC(=O)c1c(F)cccc1F)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 C24H22F2N2O4S MW 472.51 g/mol Purity >90% as per NMR
InChI
InChI=1S/C24H22F2N2O4S/c1-12(2)32-24(31)18-14(4)20(22(30)27-15-10-8-13(3)9-11-15)33-23(18)28-21(29)19-16(25)6-5-7-17(19)26/h5-12H,1-4H3,(H,27,30)(H,28,29)
InChIKey
ZNRBGIITHSJOTI-UHFFFAOYSA-N
Synonyms

CC1=CC=C(C=C1)NC(=O)C2=C(C(=C(S2)NC(=O)C3=C(C=CC=C3F)F)C(=O)OC(C)C)C
InChI=1SC24H22F2N2O4Sc112(2)3224(31)1814(4)20(22(30)271510813(3)91115)3323(18)2821(29)1916(25)65717(19)26h512H14H3(H2730)(H2829)
METHYLETHYL2((26DIFLUOROPHENYL)CARBONYLAMINO)4METHYL5(N(4METHYLPHENYL)CARBAMOYL)THIOPHENE3CARBOXYLATE
MFCD02606281
propan2yl2(((26difluorophenyl)carbonyl)amino)4methyl5((4methylphenyl)carbamoyl)thiophene3carboxylate
PROPAN2YL2((26DIFLUOROBENZOYL)AMINO)4METHYL5((4METHYLPHENYL)CARBAMOYL)THIOPHENE3CARBOXYLATE
ZINC000002760875
ZINC02760875
ZINC2760875

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Available files

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