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

Systemtic Name: (E)-2-cyano-N-cyclohexyl-3-[4-oxidanylidene-2-(4-phenylpiperazin-1-yl)pyrido[1,2-a]pyrimidin-3-yl]prop-2-enamide Openeye Name: (E)-2-cyano-N-cyclohexyl-3-[4-oxo-2-(4-phenylpiperazin-1-yl)pyrido[1,2-a]pyrimidin-3-yl]prop-2-enamide CAS Name: (E)-2-cyano-N-cyclohexyl-3-[4-oxo-2-(4-phenyl-1-piperazinyl)-3-pyrido[1,2-a]pyrimidinyl]-2-propenamide IUPAC Name: (E)-2-cyano-N-cyclohexyl-3-[4-oxo-2-(4-phenylpiperazin-1-yl)pyrido[1,2-a]pyrimidin-3-yl]prop-2-enamide Traditional Name: (E)-2-cyano-N-cyclohexyl-3-[4-keto-2-(4-phenylpiperazino)pyrido[1,2-a]pyrimidin-3-yl]acrylamide Formula: C28H30N6O2 MolecularWeight: 482.5768

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(CC1)NC(=O)C(=CC2=C(N=C3C=CC=CN3C2=O)N4CCN(CC4)C5=CC=CC=C5)C#N

Isomeric SMILES

C1CCC(CC1)NC(=O)/C(=C/C2=C(N=C3C=CC=CN3C2=O)N4CCN(CC4)C5=CC=CC=C5)/C#N

InChI

InChI=1S/C28H30N6O2/c29-20-21(27(35)30-22-9-3-1-4-10-22)19-24-26(31-25-13-7-8-14-34(25)28(24)36)33-17-15-32(16-18-33)23-11-5-2-6-12-23/h2,5-8,11-14,19,22H,1,3-4,9-10,15-18H2,(H,30,35)/b21-19+