4-[4-(3-chlorophenyl)piperazin-1-yl]-N-methyl-N-(phenylmethyl)phthalazine-1-carboxamide

Systemtic Name: 4-[4-(3-chlorophenyl)piperazin-1-yl]-N-methyl-N-(phenylmethyl)phthalazine-1-carboxamide Openeye Name: N-benzyl-4-[4-(3-chlorophenyl)piperazin-1-yl]-N-methyl-phthalazine-1-carboxamide CAS Name: 4-[4-(3-chlorophenyl)-1-piperazinyl]-N-methyl-N-(phenylmethyl)-1-phthalazinecarboxamide IUPAC Name: N-benzyl-4-[4-(3-chlorophenyl)piperazin-1-yl]-N-methylphthalazine-1-carboxamide Traditional Name: N-benzyl-4-[4-(3-chlorophenyl)piperazino]-N-methyl-phthalazine-1-carboxamide Formula: C27H26ClN5O MolecularWeight: 471.98124

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Descriptors Computed from Structure

Canonical SMILES:

CN(CC1=CC=CC=C1)C(=O)C2=NN=C(C3=CC=CC=C32)N4CCN(CC4)C5=CC(=CC=C5)Cl

Isomeric SMILES

CN(CC1=CC=CC=C1)C(=O)C2=NN=C(C3=CC=CC=C32)N4CCN(CC4)C5=CC(=CC=C5)Cl

InChI

InChI=1S/C27H26ClN5O/c1-31(19-20-8-3-2-4-9-20)27(34)25-23-12-5-6-13-24(23)26(30-29-25)33-16-14-32(15-17-33)22-11-7-10-21(28)18-22/h2-13,18H,14-17,19H2,1H3