Vitas-M small molecule compound

propan-2-yl 2-{[(4-bromophenyl)acetyl]amino}-5-(dimethylcarbamoyl)-4-methylthiophene-3-carboxylate

Catalog ID
STK452409
SMILES O=C(Nc1sc(c(c1C(=O)OC(C)C)C)C(=O)N(C)C)Cc1ccc(cc1)Br

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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 C20H23BrN2O4S MW 467.38 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H23BrN2O4S/c1-11(2)27-20(26)16-12(3)17(19(25)23(4)5)28-18(16)22-15(24)10-13-6-8-14(21)9-7-13/h6-9,11H,10H2,1-5H3,(H,22,24)
InChIKey
ZNOAIHOZEKJZFE-UHFFFAOYSA-N
Synonyms

CC1=C(SC(=C1C(=O)OC(C)C)NC(=O)CC2=CC=C(C=C2)Br)C(=O)N(C)C
InChI=1SC20H23BrN2O4Sc111(2)2720(26)1612(3)17(19(25)23(4)5)2818(16)2215(24)10136814(21)9713h6911H10H215H3(H2224)
ISOPROPYL2(((4BROMOPHENYL)ACETYL)AMINO)5((DIMETHYLAMINO)CARBONYL)4METHYLTHIOPHENE3CARBOXYLATE
METHYLETHYL5(NNDIMETHYLCARBAMOYL)2(2(4BROMOPHENYL)ACETYLAMINO)4METHYLTHIOPHENE3CARBOXYLATE
MFCD02607986
propan2yl2(((4bromophenyl)acetyl)amino)5(dimethylcarbamoyl)4methylthiophene3carboxylate
PROPAN2YL2((2(4BROMOPHENYL)ACETYL)AMINO)5(DIMETHYLCARBAMOYL)4METHYLTHIOPHENE3CARBOXYLATE
ZINC000000676122
ZINC00676122
ZINC676122

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Available files

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