4-[4-(3-chlorophenyl)piperazin-1-yl]-N-(2-dimethylaminoethyl)phthalazine-1-carboxamide

Systemtic Name: 4-[4-(3-chlorophenyl)piperazin-1-yl]-N-(2-dimethylaminoethyl)phthalazine-1-carboxamide Openeye Name: 4-[4-(3-chlorophenyl)piperazin-1-yl]-N-(2-dimethylaminoethyl)phthalazine-1-carboxamide CAS Name: 4-[4-(3-chlorophenyl)-1-piperazinyl]-N-(2-dimethylaminoethyl)-1-phthalazinecarboxamide IUPAC Name: 4-[4-(3-chlorophenyl)piperazin-1-yl]-N-(2-dimethylaminoethyl)phthalazine-1-carboxamide Traditional Name: 4-[4-(3-chlorophenyl)piperazino]-N-(2-dimethylaminoethyl)phthalazine-1-carboxamide Formula: C23H27ClN6O MolecularWeight: 438.95308

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Descriptors Computed from Structure

Canonical SMILES:

CN(C)CCNC(=O)C1=NN=C(C2=CC=CC=C21)N3CCN(CC3)C4=CC(=CC=C4)Cl

Isomeric SMILES

CN(C)CCNC(=O)C1=NN=C(C2=CC=CC=C21)N3CCN(CC3)C4=CC(=CC=C4)Cl

InChI

InChI=1S/C23H27ClN6O/c1-28(2)11-10-25-23(31)21-19-8-3-4-9-20(19)22(27-26-21)30-14-12-29(13-15-30)18-7-5-6-17(24)16-18/h3-9,16H,10-15H2,1-2H3,(H,25,31)