Vitas-M small molecule compound

methyl 4-methyl-5-(phenylcarbamoyl)-2-[(pyridin-4-ylcarbonyl)amino]thiophene-3-carboxylate

Catalog ID
STK466480
SMILES COC(=O)c1c(NC(=O)c2ccncc2)sc(c1C)C(=O)Nc1ccccc1

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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 C20H17N3O4S MW 395.44 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H17N3O4S/c1-12-15(20(26)27-2)19(23-17(24)13-8-10-21-11-9-13)28-16(12)18(25)22-14-6-4-3-5-7-14/h3-11H,1-2H3,(H,22,25)(H,23,24)
InChIKey
XKAPSEUMHSPVKC-UHFFFAOYSA-N
Synonyms

CC1=C(SC(=C1C(=O)OC)NC(=O)C2=CC=NC=C2)C(=O)NC3=CC=CC=C3
InChI=1SC20H17N3O4Sc11215(20(26)272)19(2317(24)138102111913)2816(12)18(25)22146435714h311H12H3(H2225)(H2324)
METHYL4METHYL5(NPHENYLCARBAMOYL)2(4PYRIDYLCARBONYLAMINO)THIOPHENE3CARBOXYLATE
methyl4methyl5(phenylcarbamoyl)2((pyridin4ylcarbonyl)amino)thiophene3carboxylate
METHYL4METHYL5(PHENYLCARBAMOYL)2(PYRIDINE4CARBONYLAMINO)THIOPHENE3CARBOXYLATE
MFCD06624937
ZINC000004750340
ZINC04750340
ZINC4750340

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Available files

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