N-[3-[2-[(4-chlorophenyl)amino]-5-cyano-4-oxidanylidene-1H-pyrimidin-6-yl]phenyl]naphthalene-1-carboxamide

Systemtic Name: N-[3-[2-[(4-chlorophenyl)amino]-5-cyano-4-oxidanylidene-1H-pyrimidin-6-yl]phenyl]naphthalene-1-carboxamide Openeye Name: N-[3-[2-(4-chloroanilino)-5-cyano-4-oxo-1H-pyrimidin-6-yl]phenyl]naphthalene-1-carboxamide CAS Name: N-[3-[2-(4-chloroanilino)-5-cyano-4-oxo-1H-pyrimidin-6-yl]phenyl]-1-naphthalenecarboxamide IUPAC Name: N-[3-[2-(4-chloroanilino)-5-cyano-4-oxo-1H-pyrimidin-6-yl]phenyl]naphthalene-1-carboxamide Traditional Name: N-[3-[2-(4-chloroanilino)-5-cyano-4-keto-1H-pyrimidin-6-yl]phenyl]-1-naphthamide Formula: C28H18ClN5O2 MolecularWeight: 491.92782

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C=CC=C2C(=O)NC3=CC=CC(=C3)C4=C(C(=O)N=C(N4)NC5=CC=C(C=C5)Cl)C#N

Isomeric SMILES

C1=CC=C2C(=C1)C=CC=C2C(=O)NC3=CC=CC(=C3)C4=C(C(=O)N=C(N4)NC5=CC=C(C=C5)Cl)C#N

InChI

InChI=1S/C28H18ClN5O2/c29-19-11-13-20(14-12-19)32-28-33-25(24(16-30)27(36)34-28)18-7-3-8-21(15-18)31-26(35)23-10-4-6-17-5-1-2-9-22(17)23/h1-15H,(H,31,35)(H2,32,33,34,36)