methyl 4-(4-butylphenyl)-5-methyl-2-(pyridin-3-ylcarbonylamino)thiophene-3-carboxylate

Systemtic Name: methyl 4-(4-butylphenyl)-5-methyl-2-(pyridin-3-ylcarbonylamino)thiophene-3-carboxylate Openeye Name: methyl 4-(4-butylphenyl)-5-methyl-2-(pyridine-3-carbonylamino)thiophene-3-carboxylate CAS Name: 4-(4-butylphenyl)-5-methyl-2-[[oxo(3-pyridinyl)methyl]amino]-3-thiophenecarboxylic acid methyl ester IUPAC Name: methyl 4-(4-butylphenyl)-5-methyl-2-(pyridine-3-carbonylamino)thiophene-3-carboxylate Traditional Name: 4-(4-butylphenyl)-5-methyl-2-nicotinamido-thiophene-3-carboxylic acid methyl ester Formula: C23H24N2O3S MolecularWeight: 408.51326

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC1=CC=C(C=C1)C2=C(SC(=C2C(=O)OC)NC(=O)C3=CN=CC=C3)C

Isomeric SMILES

CCCCC1=CC=C(C=C1)C2=C(SC(=C2C(=O)OC)NC(=O)C3=CN=CC=C3)C

InChI

InChI=1S/C23H24N2O3S/c1-4-5-7-16-9-11-17(12-10-16)19-15(2)29-22(20(19)23(27)28-3)25-21(26)18-8-6-13-24-14-18/h6,8-14H,4-5,7H2,1-3H3,(H,25,26)