N-(cyclopropylmethyl)-4-[4-(3,4-dichlorophenyl)piperazin-1-yl]phthalazine-1-carboxamide

Systemtic Name: N-(cyclopropylmethyl)-4-[4-(3,4-dichlorophenyl)piperazin-1-yl]phthalazine-1-carboxamide Openeye Name: N-(cyclopropylmethyl)-4-[4-(3,4-dichlorophenyl)piperazin-1-yl]phthalazine-1-carboxamide CAS Name: N-(cyclopropylmethyl)-4-[4-(3,4-dichlorophenyl)-1-piperazinyl]-1-phthalazinecarboxamide IUPAC Name: N-(cyclopropylmethyl)-4-[4-(3,4-dichlorophenyl)piperazin-1-yl]phthalazine-1-carboxamide Traditional Name: N-(cyclopropylmethyl)-4-[4-(3,4-dichlorophenyl)piperazino]phthalazine-1-carboxamide Formula: C23H23Cl2N5O MolecularWeight: 456.36762

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Descriptors Computed from Structure

Canonical SMILES:

C1CC1CNC(=O)C2=NN=C(C3=CC=CC=C32)N4CCN(CC4)C5=CC(=C(C=C5)Cl)Cl

Isomeric SMILES

C1CC1CNC(=O)C2=NN=C(C3=CC=CC=C32)N4CCN(CC4)C5=CC(=C(C=C5)Cl)Cl

InChI

InChI=1S/C23H23Cl2N5O/c24-19-8-7-16(13-20(19)25)29-9-11-30(12-10-29)22-18-4-2-1-3-17(18)21(27-28-22)23(31)26-14-15-5-6-15/h1-4,7-8,13,15H,5-6,9-12,14H2,(H,26,31)