3-[2-[bis(phenylmethyl)amino]-4-oxidanylidene-pyrido[1,2-a]pyrimidin-3-yl]-2-piperidin-1-ylcarbonyl-prop-2-enenitrile

Systemtic Name: 3-[2-[bis(phenylmethyl)amino]-4-oxidanylidene-pyrido[1,2-a]pyrimidin-3-yl]-2-piperidin-1-ylcarbonyl-prop-2-enenitrile Openeye Name: 3-[2-(dibenzylamino)-4-oxo-pyrido[1,2-a]pyrimidin-3-yl]-2-(piperidine-1-carbonyl)prop-2-enenitrile CAS Name: 3-[2-[bis(phenylmethyl)amino]-4-oxo-3-pyrido[1,2-a]pyrimidinyl]-2-[oxo(1-piperidinyl)methyl]-2-propenenitrile IUPAC Name: 3-[2-(dibenzylamino)-4-oxopyrido[1,2-a]pyrimidin-3-yl]-2-(piperidine-1-carbonyl)prop-2-enenitrile Traditional Name: 3-[2-(dibenzylamino)-4-keto-pyrido[1,2-a]pyrimidin-3-yl]-2-(piperidine-1-carbonyl)acrylonitrile Formula: C31H29N5O2 MolecularWeight: 503.59426

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CCN(CC1)C(=O)C(=CC2=C(N=C3C=CC=CN3C2=O)N(CC4=CC=CC=C4)CC5=CC=CC=C5)C#N

Isomeric SMILES

C1CCN(CC1)C(=O)C(=CC2=C(N=C3C=CC=CN3C2=O)N(CC4=CC=CC=C4)CC5=CC=CC=C5)C#N

InChI

InChI=1S/C31H29N5O2/c32-21-26(30(37)34-17-9-3-10-18-34)20-27-29(33-28-16-8-11-19-36(28)31(27)38)35(22-24-12-4-1-5-13-24)23-25-14-6-2-7-15-25/h1-2,4-8,11-16,19-20H,3,9-10,17-18,22-23H2