2-cyano-3-[9-methyl-4-oxidanylidene-2-(4-phenylpiperazin-1-yl)pyrido[1,2-a]pyrimidin-3-yl]-N-prop-2-enyl-prop-2-enamide

Systemtic Name: 2-cyano-3-[9-methyl-4-oxidanylidene-2-(4-phenylpiperazin-1-yl)pyrido[1,2-a]pyrimidin-3-yl]-N-prop-2-enyl-prop-2-enamide Openeye Name: N-allyl-2-cyano-3-[9-methyl-4-oxo-2-(4-phenylpiperazin-1-yl)pyrido[1,2-a]pyrimidin-3-yl]prop-2-enamide CAS Name: 2-cyano-3-[9-methyl-4-oxo-2-(4-phenyl-1-piperazinyl)-3-pyrido[1,2-a]pyrimidinyl]-N-prop-2-enyl-2-propenamide IUPAC Name: 2-cyano-3-[9-methyl-4-oxo-2-(4-phenylpiperazin-1-yl)pyrido[1,2-a]pyrimidin-3-yl]-N-prop-2-enylprop-2-enamide Traditional Name: N-allyl-2-cyano-3-[4-keto-9-methyl-2-(4-phenylpiperazino)pyrido[1,2-a]pyrimidin-3-yl]acrylamide Formula: C26H26N6O2 MolecularWeight: 454.52364

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CN2C1=NC(=C(C2=O)C=C(C#N)C(=O)NCC=C)N3CCN(CC3)C4=CC=CC=C4

Isomeric SMILES

CC1=CC=CN2C1=NC(=C(C2=O)C=C(C#N)C(=O)NCC=C)N3CCN(CC3)C4=CC=CC=C4

InChI

InChI=1S/C26H26N6O2/c1-3-11-28-25(33)20(18-27)17-22-24(29-23-19(2)8-7-12-32(23)26(22)34)31-15-13-30(14-16-31)21-9-5-4-6-10-21/h3-10,12,17H,1,11,13-16H2,2H3,(H,28,33)