Vitas-M small molecule compound

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

Catalog ID
STK452507
SMILES COC(=O)c1c(sc(c1C)C(=O)Nc1ccc(cc1)OC)NC(=O)c1cccnc1

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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 C21H19N3O5S MW 425.47 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H19N3O5S/c1-12-16(21(27)29-3)20(24-18(25)13-5-4-10-22-11-13)30-17(12)19(26)23-14-6-8-15(28-2)9-7-14/h4-11H,1-3H3,(H,23,26)(H,24,25)
InChIKey
QFUJEMVBUCNMEH-UHFFFAOYSA-N
Synonyms

CC1=C(SC(=C1C(=O)OC)NC(=O)C2=CN=CC=C2)C(=O)NC3=CC=C(C=C3)OC
InChI=1SC21H19N3O5Sc11216(21(27)293)20(2418(25)135410221113)3017(12)19(26)23146815(282)9714h411H13H3(H2326)(H2425)
METHYL5((4METHOXYANILINO)CARBONYL)4METHYL2((3PYRIDINYLCARBONYL)AMINO)3THIOPHENECARBOXYLATE
methyl5((4methoxyphenyl)carbamoyl)4methyl2((pyridin3ylcarbonyl)amino)thiophene3carboxylate
METHYL5((4METHOXYPHENYL)CARBAMOYL)4METHYL2(PYRIDINE3CARBONYLAMINO)THIOPHENE3CARBOXYLATE
METHYL5(N(4METHOXYPHENYL)CARBAMOYL)4METHYL2(3PYRIDYLCARBONYLAMINO)THIOPHENE3CARBOXYLATE
MFCD02607116
ZINC000000676018
ZINC00676018
ZINC676018

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Available files

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