Vitas-M small molecule compound

methyl 5-(diethylcarbamoyl)-4-methyl-2-({[2-(3-methylphenyl)quinolin-4-yl]carbonyl}amino)thiophene-3-carboxylate

Catalog ID
STK419243
SMILES CCN(C(=O)c1sc(c(c1C)C(=O)OC)NC(=O)c1cc(nc2c1cccc2)c1cccc(c1)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 C29H29N3O4S MW 515.63 g/mol Purity >90% as per NMR
InChI
InChI=1S/C29H29N3O4S/c1-6-32(7-2)28(34)25-18(4)24(29(35)36-5)27(37-25)31-26(33)21-16-23(19-12-10-11-17(3)15-19)30-22-14-9-8-13-20(21)22/h8-16H,6-7H2,1-5H3,(H,31,33)
InChIKey
CWKMYTRJRIARRB-UHFFFAOYSA-N
Synonyms
353477-83-5
353477835
CCN(CC)C(=O)C1=C(C(=C(S1)NC(=O)C2=CC(=NC3=CC=CC=C32)C4=CC(=CC=C4)C)C(=O)OC)C
InChI=1SC29H29N3O4Sc1632(72)28(34)2518(4)24(29(35)365)27(3725)3126(33)211623(1912101117(3)1519)302214981320(21)22h816H67H215H3(H3133)
METHYL5((DIETHYLAMINO)CARBONYL)4METHYL2(((2(3METHYLPHENYL)4QUINOLINYL)CARBONYL)AMINO)3THIOPHENECARBOXYLATE
methyl5(diethylcarbamoyl)4methyl2(((2(3methylphenyl)quinolin4yl)carbonyl)amino)thiophene3carboxylate
METHYL5(DIETHYLCARBAMOYL)4METHYL2((2(3METHYLPHENYL)QUINOLINE4CARBONYL)AMINO)THIOPHENE3CARBOXYLATE
METHYL5(DIETHYLCARBAMOYL)4METHYL2((2(MTOLYL)QUINOLINE4CARBONYL)AMINO)THIOPHENE3CARBOXYLATE
METHYL5(DIETHYLCARBAMOYL)4METHYL2(2MTOLYLQUINOLINE4CARBOXAMIDO)THIOPHENE3CARBOXYLATE
MFCD01357774
ZINC000002084106
ZINC02084106
ZINC2084106

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Available files

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