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

Systemtic Name: 3-[(2-methyl-4-piperidin-1-yl-7,8-dihydro-5H-pyrido[4,3-d]pyrimidin-6-yl)carbonyl]benzenecarbonitrile Openeye Name: 3-[2-methyl-4-(1-piperidyl)-7,8-dihydro-5H-pyrido[4,3-d]pyrimidine-6-carbonyl]benzonitrile CAS Name: 3-[[2-methyl-4-(1-piperidinyl)-7,8-dihydro-5H-pyrido[4,3-d]pyrimidin-6-yl]-oxomethyl]benzonitrile IUPAC Name: 3-(2-methyl-4-piperidin-1-yl-7,8-dihydro-5H-pyrido[4,3-d]pyrimidine-6-carbonyl)benzonitrile Traditional Name: 3-(2-methyl-4-piperidino-7,8-dihydro-5H-pyrido[4,3-d]pyrimidine-6-carbonyl)benzonitrile Formula: C21H23N5O MolecularWeight: 361.44022

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC2=C(CN(CC2)C(=O)C3=CC=CC(=C3)C#N)C(=N1)N4CCCCC4

Isomeric SMILES

CC1=NC2=C(CN(CC2)C(=O)C3=CC=CC(=C3)C#N)C(=N1)N4CCCCC4

InChI

InChI=1S/C21H23N5O/c1-15-23-19-8-11-26(21(27)17-7-5-6-16(12-17)13-22)14-18(19)20(24-15)25-9-3-2-4-10-25/h5-7,12H,2-4,8-11,14H2,1H3