N-[2-(4-methyl-2-phenyl-piperazin-1-yl)ethyl]-4-oxidanylidene-3-propyl-phthalazine-1-carboxamide

Systemtic Name: N-[2-(4-methyl-2-phenyl-piperazin-1-yl)ethyl]-4-oxidanylidene-3-propyl-phthalazine-1-carboxamide Openeye Name: N-[2-(4-methyl-2-phenyl-piperazin-1-yl)ethyl]-4-oxo-3-propyl-phthalazine-1-carboxamide CAS Name: N-[2-(4-methyl-2-phenyl-1-piperazinyl)ethyl]-4-oxo-3-propyl-1-phthalazinecarboxamide IUPAC Name: N-[2-(4-methyl-2-phenylpiperazin-1-yl)ethyl]-4-oxo-3-propylphthalazine-1-carboxamide Traditional Name: 4-keto-N-[2-(4-methyl-2-phenyl-piperazino)ethyl]-3-propyl-phthalazine-1-carboxamide Formula: C25H31N5O2 MolecularWeight: 433.54594

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Descriptors Computed from Structure

Canonical SMILES:

CCCN1C(=O)C2=CC=CC=C2C(=N1)C(=O)NCCN3CCN(CC3C4=CC=CC=C4)C

Isomeric SMILES

CCCN1C(=O)C2=CC=CC=C2C(=N1)C(=O)NCCN3CCN(CC3C4=CC=CC=C4)C

InChI

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