ethyl 6-[[(2-chlorophenyl)amino]methyl]-2-oxidanylidene-4-thiophen-2-yl-3,4-dihydro-1H-pyrimidine-5-carboxylate

Systemtic Name: ethyl 6-[[(2-chlorophenyl)amino]methyl]-2-oxidanylidene-4-thiophen-2-yl-3,4-dihydro-1H-pyrimidine-5-carboxylate Openeye Name: ethyl 6-[(2-chloroanilino)methyl]-2-oxo-4-(2-thienyl)-3,4-dihydro-1H-pyrimidine-5-carboxylate CAS Name: 6-[(2-chloroanilino)methyl]-2-oxo-4-thiophen-2-yl-3,4-dihydro-1H-pyrimidine-5-carboxylic acid ethyl ester IUPAC Name: ethyl 6-[(2-chloroanilino)methyl]-2-oxo-4-thiophen-2-yl-3,4-dihydro-1H-pyrimidine-5-carboxylate Traditional Name: 6-[(2-chloroanilino)methyl]-2-keto-4-(2-thienyl)-3,4-dihydro-1H-pyrimidine-5-carboxylic acid ethyl ester Formula: C18H18ClN3O3S MolecularWeight: 391.87182

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(NC(=O)NC1C2=CC=CS2)CNC3=CC=CC=C3Cl

Isomeric SMILES

CCOC(=O)C1=C(NC(=O)NC1C2=CC=CS2)CNC3=CC=CC=C3Cl

InChI

InChI=1S/C18H18ClN3O3S/c1-2-25-17(23)15-13(10-20-12-7-4-3-6-11(12)19)21-18(24)22-16(15)14-8-5-9-26-14/h3-9,16,20H,2,10H2,1H3,(H2,21,22,24)