N-[3-(4-dimethylaminophenyl)propyl]-4-oxidanylidene-3-(phenylmethyl)phthalazine-1-carboxamide

Systemtic Name: N-[3-(4-dimethylaminophenyl)propyl]-4-oxidanylidene-3-(phenylmethyl)phthalazine-1-carboxamide Openeye Name: 3-benzyl-N-[3-(4-dimethylaminophenyl)propyl]-4-oxo-phthalazine-1-carboxamide CAS Name: N-[3-(4-dimethylaminophenyl)propyl]-4-oxo-3-(phenylmethyl)-1-phthalazinecarboxamide IUPAC Name: 3-benzyl-N-[3-(4-dimethylaminophenyl)propyl]-4-oxophthalazine-1-carboxamide Traditional Name: 3-benzyl-N-[3-(4-dimethylaminophenyl)propyl]-4-keto-phthalazine-1-carboxamide Formula: C27H28N4O2 MolecularWeight: 440.53682

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Descriptors Computed from Structure

Canonical SMILES:

CN(C)C1=CC=C(C=C1)CCCNC(=O)C2=NN(C(=O)C3=CC=CC=C32)CC4=CC=CC=C4

Isomeric SMILES

CN(C)C1=CC=C(C=C1)CCCNC(=O)C2=NN(C(=O)C3=CC=CC=C32)CC4=CC=CC=C4

InChI

InChI=1S/C27H28N4O2/c1-30(2)22-16-14-20(15-17-22)11-8-18-28-26(32)25-23-12-6-7-13-24(23)27(33)31(29-25)19-21-9-4-3-5-10-21/h3-7,9-10,12-17H,8,11,18-19H2,1-2H3,(H,28,32)