6-azanyl-5-[(3-chlorophenyl)methylideneamino]-2-oxidanylidene-1-phenyl-pyrimidine-4-carbonitrile

Systemtic Name: 6-azanyl-5-[(3-chlorophenyl)methylideneamino]-2-oxidanylidene-1-phenyl-pyrimidine-4-carbonitrile Openeye Name: 6-amino-5-[(3-chlorophenyl)methyleneamino]-2-oxo-1-phenyl-pyrimidine-4-carbonitrile CAS Name: 6-amino-5-[(3-chlorophenyl)methylideneamino]-2-oxo-1-phenyl-4-pyrimidinecarbonitrile IUPAC Name: 6-amino-5-[(3-chlorophenyl)methylideneamino]-2-oxo-1-phenylpyrimidine-4-carbonitrile Traditional Name: 6-amino-5-[(3-chlorobenzylidene)amino]-2-keto-1-phenyl-pyrimidine-4-carbonitrile Formula: C18H12ClN5O MolecularWeight: 349.77378

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)N2C(=C(C(=NC2=O)C#N)N=CC3=CC(=CC=C3)Cl)N

Isomeric SMILES

C1=CC=C(C=C1)N2C(=C(C(=NC2=O)C#N)N=CC3=CC(=CC=C3)Cl)N

InChI

InChI=1S/C18H12ClN5O/c19-13-6-4-5-12(9-13)11-22-16-15(10-20)23-18(25)24(17(16)21)14-7-2-1-3-8-14/h1-9,11H,21H2