ethyl 6-[[(4-chloranyl-3-cyano-phenyl)amino]methyl]-2-oxidanylidene-3,4-dihydro-1H-pyrimidine-5-carboxylate

Systemtic Name: ethyl 6-[[(4-chloranyl-3-cyano-phenyl)amino]methyl]-2-oxidanylidene-3,4-dihydro-1H-pyrimidine-5-carboxylate Openeye Name: ethyl 6-[(4-chloro-3-cyano-anilino)methyl]-2-oxo-3,4-dihydro-1H-pyrimidine-5-carboxylate CAS Name: 6-[(4-chloro-3-cyanoanilino)methyl]-2-oxo-3,4-dihydro-1H-pyrimidine-5-carboxylic acid ethyl ester IUPAC Name: ethyl 6-[(4-chloro-3-cyanoanilino)methyl]-2-oxo-3,4-dihydro-1H-pyrimidine-5-carboxylate Traditional Name: 6-[(4-chloro-3-cyano-anilino)methyl]-2-keto-3,4-dihydro-1H-pyrimidine-5-carboxylic acid ethyl ester Formula: C15H15ClN4O3 MolecularWeight: 334.7576

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(NC(=O)NC1)CNC2=CC(=C(C=C2)Cl)C#N

Isomeric SMILES

CCOC(=O)C1=C(NC(=O)NC1)CNC2=CC(=C(C=C2)Cl)C#N

InChI

InChI=1S/C15H15ClN4O3/c1-2-23-14(21)11-7-19-15(22)20-13(11)8-18-10-3-4-12(16)9(5-10)6-17/h3-5,18H,2,7-8H2,1H3,(H2,19,20,22)