N-(cyclohexylmethyl)-6-[4-[4-(phenylmethyl)phthalazin-1-yl]piperazin-1-yl]pyridine-3-carboxamide

Systemtic Name: N-(cyclohexylmethyl)-6-[4-[4-(phenylmethyl)phthalazin-1-yl]piperazin-1-yl]pyridine-3-carboxamide Openeye Name: 6-[4-(4-benzylphthalazin-1-yl)piperazin-1-yl]-N-(cyclohexylmethyl)pyridine-3-carboxamide CAS Name: N-(cyclohexylmethyl)-6-[4-[4-(phenylmethyl)-1-phthalazinyl]-1-piperazinyl]-3-pyridinecarboxamide IUPAC Name: 6-[4-(4-benzylphthalazin-1-yl)piperazin-1-yl]-N-(cyclohexylmethyl)pyridine-3-carboxamide Traditional Name: 6-[4-(4-benzylphthalazin-1-yl)piperazino]-N-(cyclohexylmethyl)nicotinamide Formula: C32H36N6O MolecularWeight: 520.66784

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(CC1)CNC(=O)C2=CN=C(C=C2)N3CCN(CC3)C4=NN=C(C5=CC=CC=C54)CC6=CC=CC=C6

Isomeric SMILES

C1CCC(CC1)CNC(=O)C2=CN=C(C=C2)N3CCN(CC3)C4=NN=C(C5=CC=CC=C54)CC6=CC=CC=C6

InChI

InChI=1S/C32H36N6O/c39-32(34-22-25-11-5-2-6-12-25)26-15-16-30(33-23-26)37-17-19-38(20-18-37)31-28-14-8-7-13-27(28)29(35-36-31)21-24-9-3-1-4-10-24/h1,3-4,7-10,13-16,23,25H,2,5-6,11-12,17-22H2,(H,34,39)