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

Systemtic Name: 3-methyl-4-oxidanylidene-N-[2-[4-(phenylmethyl)piperazin-1-yl]ethyl]phthalazine-1-carboxamide Openeye Name: N-[2-(4-benzylpiperazin-1-yl)ethyl]-3-methyl-4-oxo-phthalazine-1-carboxamide CAS Name: 3-methyl-4-oxo-N-[2-[4-(phenylmethyl)-1-piperazinyl]ethyl]-1-phthalazinecarboxamide IUPAC Name: N-[2-(4-benzylpiperazin-1-yl)ethyl]-3-methyl-4-oxophthalazine-1-carboxamide Traditional Name: N-[2-(4-benzylpiperazino)ethyl]-4-keto-3-methyl-phthalazine-1-carboxamide Formula: C23H27N5O2 MolecularWeight: 405.49278

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Descriptors Computed from Structure

Canonical SMILES:

CN1C(=O)C2=CC=CC=C2C(=N1)C(=O)NCCN3CCN(CC3)CC4=CC=CC=C4

Isomeric SMILES

CN1C(=O)C2=CC=CC=C2C(=N1)C(=O)NCCN3CCN(CC3)CC4=CC=CC=C4

InChI

InChI=1S/C23H27N5O2/c1-26-23(30)20-10-6-5-9-19(20)21(25-26)22(29)24-11-12-27-13-15-28(16-14-27)17-18-7-3-2-4-8-18/h2-10H,11-17H2,1H3,(H,24,29)