2-cyano-3-[4-oxidanylidene-2-(4-phenylpiperazin-1-yl)pyrido[1,2-a]pyrimidin-3-yl]-N-phenethyl-prop-2-enamide

Systemtic Name: 2-cyano-3-[4-oxidanylidene-2-(4-phenylpiperazin-1-yl)pyrido[1,2-a]pyrimidin-3-yl]-N-phenethyl-prop-2-enamide Openeye Name: 2-cyano-3-[4-oxo-2-(4-phenylpiperazin-1-yl)pyrido[1,2-a]pyrimidin-3-yl]-N-phenethyl-prop-2-enamide CAS Name: 2-cyano-3-[4-oxo-2-(4-phenyl-1-piperazinyl)-3-pyrido[1,2-a]pyrimidinyl]-N-phenethyl-2-propenamide IUPAC Name: 2-cyano-3-[4-oxo-2-(4-phenylpiperazin-1-yl)pyrido[1,2-a]pyrimidin-3-yl]-N-phenethylprop-2-enamide Traditional Name: 2-cyano-3-[4-keto-2-(4-phenylpiperazino)pyrido[1,2-a]pyrimidin-3-yl]-N-phenethyl-acrylamide Formula: C30H28N6O2 MolecularWeight: 504.58232

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1C2=CC=CC=C2)C3=C(C(=O)N4C=CC=CC4=N3)C=C(C#N)C(=O)NCCC5=CC=CC=C5

Isomeric SMILES

C1CN(CCN1C2=CC=CC=C2)C3=C(C(=O)N4C=CC=CC4=N3)C=C(C#N)C(=O)NCCC5=CC=CC=C5

InChI

InChI=1S/C30H28N6O2/c31-22-24(29(37)32-15-14-23-9-3-1-4-10-23)21-26-28(33-27-13-7-8-16-36(27)30(26)38)35-19-17-34(18-20-35)25-11-5-2-6-12-25/h1-13,16,21H,14-15,17-20H2,(H,32,37)