ethyl 4-(2,4-dimethylphenyl)-2-(pyridin-4-ylcarbonylamino)thiophene-3-carboxylate

Systemtic Name: ethyl 4-(2,4-dimethylphenyl)-2-(pyridin-4-ylcarbonylamino)thiophene-3-carboxylate Openeye Name: ethyl 4-(2,4-dimethylphenyl)-2-(pyridine-4-carbonylamino)thiophene-3-carboxylate CAS Name: 4-(2,4-dimethylphenyl)-2-[[oxo(pyridin-4-yl)methyl]amino]-3-thiophenecarboxylic acid ethyl ester IUPAC Name: ethyl 4-(2,4-dimethylphenyl)-2-(pyridine-4-carbonylamino)thiophene-3-carboxylate Traditional Name: 4-(2,4-dimethylphenyl)-2-isonicotinamido-thiophene-3-carboxylic acid ethyl ester Formula: C21H20N2O3S MolecularWeight: 380.4601

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(SC=C1C2=C(C=C(C=C2)C)C)NC(=O)C3=CC=NC=C3

Isomeric SMILES

CCOC(=O)C1=C(SC=C1C2=C(C=C(C=C2)C)C)NC(=O)C3=CC=NC=C3

InChI

InChI=1S/C21H20N2O3S/c1-4-26-21(25)18-17(16-6-5-13(2)11-14(16)3)12-27-20(18)23-19(24)15-7-9-22-10-8-15/h5-12H,4H2,1-3H3,(H,23,24)