4-[4-(4-methoxyphenyl)piperazin-1-yl]-N-(3-methylbutyl)phthalazine-1-carboxamide

Systemtic Name: 4-[4-(4-methoxyphenyl)piperazin-1-yl]-N-(3-methylbutyl)phthalazine-1-carboxamide Openeye Name: N-isopentyl-4-[4-(4-methoxyphenyl)piperazin-1-yl]phthalazine-1-carboxamide CAS Name: 4-[4-(4-methoxyphenyl)-1-piperazinyl]-N-(3-methylbutyl)-1-phthalazinecarboxamide IUPAC Name: 4-[4-(4-methoxyphenyl)piperazin-1-yl]-N-(3-methylbutyl)phthalazine-1-carboxamide Traditional Name: N-isoamyl-4-[4-(4-methoxyphenyl)piperazino]phthalazine-1-carboxamide Formula: C25H31N5O2 MolecularWeight: 433.54594

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C25H31N5O2/c1-18(2)12-13-26-25(31)23-21-6-4-5-7-22(21)24(28-27-23)30-16-14-29(15-17-30)19-8-10-20(32-3)11-9-19/h4-11,18H,12-17H2,1-3H3,(H,26,31)