Vitas-M small molecule compound

methyl 2-{[(2-fluorophenyl)carbonyl]amino}-4-methyl-5-[(1-phenylethyl)carbamoyl]thiophene-3-carboxylate

Catalog ID
STK407096
SMILES COC(=O)c1c(sc(c1C)C(=O)NC(c1ccccc1)C)NC(=O)c1ccccc1F

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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 C23H21FN2O4S MW 440.50 g/mol Purity >90% as per NMR
InChI
InChI=1S/C23H21FN2O4S/c1-13-18(23(29)30-3)22(26-20(27)16-11-7-8-12-17(16)24)31-19(13)21(28)25-14(2)15-9-5-4-6-10-15/h4-12,14H,1-3H3,(H,25,28)(H,26,27)
InChIKey
WPCOCMQWMQKRCK-UHFFFAOYSA-N
Synonyms

CC1=C(SC(=C1C(=O)OC)NC(=O)C2=CC=CC=C2F)C(=O)NC(C)C3=CC=CC=C3
InChI=1SC23H21FN2O4Sc11318(23(29)303)22(2620(27)1611781217(16)24)3119(13)21(28)2514(2)1595461015h41214H13H3(H2528)(H2627)
methyl2(((2fluorophenyl)carbonyl)amino)4methyl5((1phenylethyl)carbamoyl)thiophene3carboxylate
METHYL2((2FLUOROBENZOYL)AMINO)4METHYL5(((1R)1PHENYLETHYL)CARBAMOYL)THIOPHENE3CARBOXYLATE
METHYL2((2FLUOROBENZOYL)AMINO)4METHYL5(((1S)1PHENYLETHYL)CARBAMOYL)THIOPHENE3CARBOXYLATE
METHYL2((2FLUOROBENZOYL)AMINO)4METHYL5(1PHENYLETHYLCARBAMOYL)THIOPHENE3CARBOXYLATE
METHYL2((2FLUOROPHENYL)CARBONYLAMINO)4METHYL5(N(PHENYLETHYL)CARBAMOYL)THIOPHENE3CARBOXYLATE
MFCD06628191
ZINC000002881002
ZINC000002881003

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Available files

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