N-methyl-4-oxidanylidene-3-(phenylmethyl)-N-[(2-pyrrolidin-1-ylphenyl)methyl]phthalazine-1-carboxamide

Systemtic Name: N-methyl-4-oxidanylidene-3-(phenylmethyl)-N-[(2-pyrrolidin-1-ylphenyl)methyl]phthalazine-1-carboxamide Openeye Name: 3-benzyl-N-methyl-4-oxo-N-[(2-pyrrolidin-1-ylphenyl)methyl]phthalazine-1-carboxamide CAS Name: N-methyl-4-oxo-3-(phenylmethyl)-N-[[2-(1-pyrrolidinyl)phenyl]methyl]-1-phthalazinecarboxamide IUPAC Name: 3-benzyl-N-methyl-4-oxo-N-[(2-pyrrolidin-1-ylphenyl)methyl]phthalazine-1-carboxamide Traditional Name: 3-benzyl-4-keto-N-methyl-N-(2-pyrrolidinobenzyl)phthalazine-1-carboxamide Formula: C28H28N4O2 MolecularWeight: 452.54752

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Descriptors Computed from Structure

Canonical SMILES:

CN(CC1=CC=CC=C1N2CCCC2)C(=O)C3=NN(C(=O)C4=CC=CC=C43)CC5=CC=CC=C5

Isomeric SMILES

CN(CC1=CC=CC=C1N2CCCC2)C(=O)C3=NN(C(=O)C4=CC=CC=C43)CC5=CC=CC=C5

InChI

InChI=1S/C28H28N4O2/c1-30(20-22-13-5-8-16-25(22)31-17-9-10-18-31)28(34)26-23-14-6-7-15-24(23)27(33)32(29-26)19-21-11-3-2-4-12-21/h2-8,11-16H,9-10,17-20H2,1H3