ethyl 4-methyl-5-(methylcarbamoyl)-2-[(2-methylquinolin-4-yl)carbonylamino]thiophene-3-carboxylate

Systemtic Name: ethyl 4-methyl-5-(methylcarbamoyl)-2-[(2-methylquinolin-4-yl)carbonylamino]thiophene-3-carboxylate Openeye Name: ethyl 4-methyl-5-(methylcarbamoyl)-2-[(2-methylquinoline-4-carbonyl)amino]thiophene-3-carboxylate CAS Name: 4-methyl-5-(methylcarbamoyl)-2-[[(2-methyl-4-quinolinyl)-oxomethyl]amino]-3-thiophenecarboxylic acid ethyl ester IUPAC Name: ethyl 4-methyl-5-(methylcarbamoyl)-2-[(2-methylquinoline-4-carbonyl)amino]thiophene-3-carboxylate Traditional Name: 4-methyl-5-(methylcarbamoyl)-2-[(2-methylquinoline-4-carbonyl)amino]thiophene-3-carboxylic acid ethyl ester Formula: C21H21N3O4S MolecularWeight: 411.47414

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(SC(=C1C)C(=O)NC)NC(=O)C2=CC(=NC3=CC=CC=C32)C

Isomeric SMILES

CCOC(=O)C1=C(SC(=C1C)C(=O)NC)NC(=O)C2=CC(=NC3=CC=CC=C32)C

InChI

InChI=1S/C21H21N3O4S/c1-5-28-21(27)16-12(3)17(19(26)22-4)29-20(16)24-18(25)14-10-11(2)23-15-9-7-6-8-13(14)15/h6-10H,5H2,1-4H3,(H,22,26)(H,24,25)