Vitas-M small molecule compound

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

Catalog ID
STK421684
SMILES CCN(C(=O)c1sc(c(c1C)C(=O)OC)NC(=O)c1cc(nc2c1cccc2)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 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(19-14-12-17(3)13-15-19)30-22-11-9-8-10-20(21)22/h8-16H,6-7H2,1-5H3,(H,31,33)
InChIKey
QWHJRURXALWLHR-UHFFFAOYSA-N
Synonyms
353474-79-0
353474790
CCN(CC)C(=O)C1=C(C(=C(S1)NC(=O)C2=CC(=NC3=CC=CC=C32)C4=CC=C(C=C4)C)C(=O)OC)C
InChI=1SC29H29N3O4Sc1632(72)28(34)2518(4)24(29(35)365)27(3725)3126(33)211623(19141217(3)131519)302211981020(21)22h816H67H215H3(H3133)
METHYL5((DIETHYLAMINO)CARBONYL)4METHYL2(((2(4METHYLPHENYL)4QUINOLINYL)CARBONYL)AMINO)3THIOPHENECARBOXYLATE
methyl5(diethylcarbamoyl)4methyl2(((2(4methylphenyl)quinolin4yl)carbonyl)amino)thiophene3carboxylate
METHYL5(DIETHYLCARBAMOYL)4METHYL2((2(4METHYLPHENYL)QUINOLINE4CARBONYL)AMINO)THIOPHENE3CARBOXYLATE
MFCD01344496
ZINC000002081580
ZINC02081580
ZINC2081580

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Available files

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