N-methyl-4-oxidanylidene-3-(phenylmethyl)-N-[(4-piperidin-1-ylphenyl)methyl]phthalazine-1-carboxamide

Systemtic Name: N-methyl-4-oxidanylidene-3-(phenylmethyl)-N-[(4-piperidin-1-ylphenyl)methyl]phthalazine-1-carboxamide Openeye Name: 3-benzyl-N-methyl-4-oxo-N-[[4-(1-piperidyl)phenyl]methyl]phthalazine-1-carboxamide CAS Name: N-methyl-4-oxo-3-(phenylmethyl)-N-[[4-(1-piperidinyl)phenyl]methyl]-1-phthalazinecarboxamide IUPAC Name: 3-benzyl-N-methyl-4-oxo-N-[(4-piperidin-1-ylphenyl)methyl]phthalazine-1-carboxamide Traditional Name: 3-benzyl-4-keto-N-methyl-N-(4-piperidinobenzyl)phthalazine-1-carboxamide Formula: C29H30N4O2 MolecularWeight: 466.5741

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Descriptors Computed from Structure

Canonical SMILES:

CN(CC1=CC=C(C=C1)N2CCCCC2)C(=O)C3=NN(C(=O)C4=CC=CC=C43)CC5=CC=CC=C5

Isomeric SMILES

CN(CC1=CC=C(C=C1)N2CCCCC2)C(=O)C3=NN(C(=O)C4=CC=CC=C43)CC5=CC=CC=C5

InChI

InChI=1S/C29H30N4O2/c1-31(20-23-14-16-24(17-15-23)32-18-8-3-9-19-32)29(35)27-25-12-6-7-13-26(25)28(34)33(30-27)21-22-10-4-2-5-11-22/h2,4-7,10-17H,3,8-9,18-21H2,1H3