1-[4-(4-methylpiperazin-1-yl)-2-phenyl-7,8-dihydro-5H-pyrido[4,3-d]pyrimidin-6-yl]nonan-1-one

Systemtic Name: 1-[4-(4-methylpiperazin-1-yl)-2-phenyl-7,8-dihydro-5H-pyrido[4,3-d]pyrimidin-6-yl]nonan-1-one Openeye Name: 1-[4-(4-methylpiperazin-1-yl)-2-phenyl-7,8-dihydro-5H-pyrido[4,3-d]pyrimidin-6-yl]nonan-1-one CAS Name: 1-[4-(4-methyl-1-piperazinyl)-2-phenyl-7,8-dihydro-5H-pyrido[4,3-d]pyrimidin-6-yl]-1-nonanone IUPAC Name: 1-[4-(4-methylpiperazin-1-yl)-2-phenyl-7,8-dihydro-5H-pyrido[4,3-d]pyrimidin-6-yl]nonan-1-one Traditional Name: 1-[4-(4-methylpiperazino)-2-phenyl-7,8-dihydro-5H-pyrido[4,3-d]pyrimidin-6-yl]nonan-1-one Formula: C27H39N5O MolecularWeight: 449.63146

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCC(=O)N1CCC2=C(C1)C(=NC(=N2)C3=CC=CC=C3)N4CCN(CC4)C

Isomeric SMILES

CCCCCCCCC(=O)N1CCC2=C(C1)C(=NC(=N2)C3=CC=CC=C3)N4CCN(CC4)C

InChI

InChI=1S/C27H39N5O/c1-3-4-5-6-7-11-14-25(33)32-16-15-24-23(21-32)27(31-19-17-30(2)18-20-31)29-26(28-24)22-12-9-8-10-13-22/h8-10,12-13H,3-7,11,14-21H2,1-2H3