Vitas-M small molecule compound

methyl 4-carbamoyl-3-methyl-5-({[3-(trifluoromethyl)phenyl]carbonyl}amino)thiophene-2-carboxylate

Catalog ID
STL176432
SMILES COC(=O)c1sc(c(c1C)C(=O)N)NC(=O)c1cccc(c1)C(F)(F)F

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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 C16H13F3N2O4S MW 386.35 g/mol Purity >90% as per NMR
InChI
InChI=1S/C16H13F3N2O4S/c1-7-10(12(20)22)14(26-11(7)15(24)25-2)21-13(23)8-4-3-5-9(6-8)16(17,18)19/h3-6H,1-2H3,(H2,20,22)(H,21,23)
InChIKey
BPTPYSHEFQODLL-UHFFFAOYSA-N
Synonyms
769145-13-3
769145133
CC1=C(SC(=C1C(=O)N)NC(=O)C2=CC(=CC=C2)C(F)(F)F)C(=O)OC
InChI=1SC16H13F3N2O4Sc1710(12(20)22)14(2611(7)15(24)252)2113(23)84359(68)16(1718)19h36H12H3(H22022)(H2123)
methyl4carbamoyl3methyl5(((3(trifluoromethyl)phenyl)carbonyl)amino)thiophene2carboxylate
METHYL4CARBAMOYL3METHYL5((3(TRIFLUOROMETHYL)BENZOYL)AMINO)THIOPHENE2CARBOXYLATE
METHYL4CARBAMOYL3METHYL5(3(TRIFLUOROMETHYL)BENZAMIDO)THIOPHENE2CARBOXYLATE
MFCD04048763
ZINC000002758692
ZINC02758692
ZINC2758692

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Available files

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