3-[(2-phenyl-4-pyrrolidin-1-yl-7,8-dihydro-5H-pyrido[4,3-d]pyrimidin-6-yl)carbonyl]benzenecarbonitrile

Systemtic Name: 3-[(2-phenyl-4-pyrrolidin-1-yl-7,8-dihydro-5H-pyrido[4,3-d]pyrimidin-6-yl)carbonyl]benzenecarbonitrile Openeye Name: 3-(2-phenyl-4-pyrrolidin-1-yl-7,8-dihydro-5H-pyrido[4,3-d]pyrimidine-6-carbonyl)benzonitrile CAS Name: 3-[oxo-[2-phenyl-4-(1-pyrrolidinyl)-7,8-dihydro-5H-pyrido[4,3-d]pyrimidin-6-yl]methyl]benzonitrile IUPAC Name: 3-(2-phenyl-4-pyrrolidin-1-yl-7,8-dihydro-5H-pyrido[4,3-d]pyrimidine-6-carbonyl)benzonitrile Traditional Name: 3-(2-phenyl-4-pyrrolidino-7,8-dihydro-5H-pyrido[4,3-d]pyrimidine-6-carbonyl)benzonitrile Formula: C25H23N5O MolecularWeight: 409.48302

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(C1)C2=NC(=NC3=C2CN(CC3)C(=O)C4=CC=CC(=C4)C#N)C5=CC=CC=C5

Isomeric SMILES

C1CCN(C1)C2=NC(=NC3=C2CN(CC3)C(=O)C4=CC=CC(=C4)C#N)C5=CC=CC=C5

InChI

InChI=1S/C25H23N5O/c26-16-18-7-6-10-20(15-18)25(31)30-14-11-22-21(17-30)24(29-12-4-5-13-29)28-23(27-22)19-8-2-1-3-9-19/h1-3,6-10,15H,4-5,11-14,17H2