Vitas-M small molecule compound
methyl 2-({[6-bromo-2-(4-methylphenyl)quinolin-4-yl]carbonyl}amino)-5-(diethylcarbamoyl)-4-methylthiophene-3-carboxylate
Catalog ID
STK422355
SMILES CCN(C(=O)c1sc(c(c1C)C(=O)OC)NC(=O)c1cc(nc2c1cc(Br)cc2)c1ccc(cc1)C)CC
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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 C29H28BrN3O4S MW 594.53 g/mol Purity >90% as per NMR
InChI
InChI=1S/C29H28BrN3O4S/c1-6-33(7-2)28(35)25-17(4)24(29(36)37-5)27(38-25)32-26(34)21-15-23(18-10-8-16(3)9-11-18)31-22-13-12-19(30)14-20(21)22/h8-15H,6-7H2,1-5H3,(H,32,34)InChIKey
GKXDQWNIRGJFQV-UHFFFAOYSA-NSynonyms
CCN(CC)C(=O)C1=C(C(=C(S1)NC(=O)C2=CC(=NC3=C2C=C(C=C3)Br)C4=CC=C(C=C4)C)C(=O)OC)C
InChI=1SC29H28BrN3O4Sc1633(72)28(35)2517(4)24(29(36)375)27(3825)3226(34)211523(1810816(3)91118)3122131219(30)1420(21)22h815H67H215H3(H3234)
methyl2(((6bromo2(4methylphenyl)quinolin4yl)carbonyl)amino)5(diethylcarbamoyl)4methylthiophene3carboxylate
METHYL2((6BROMO2(4METHYLPHENYL)QUINOLINE4CARBONYL)AMINO)5(DIETHYLCARBAMOYL)4METHYLTHIOPHENE3CARBOXYLATE
METHYL5(NNDIETHYLCARBAMOYL)2((6BROMO2(4METHYLPHENYL)(4QUINOLYL))CARBONYLAMINO)4METHYLTHIOPHENE3CARBOXYLATE
MFCD02176558
ZINC000002759385
ZINC2759385
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