N-[[4-[(2-methylpiperidin-1-yl)methyl]phenyl]methyl]-4-oxidanylidene-3-propan-2-yl-phthalazine-1-carboxamide

Systemtic Name: N-[[4-[(2-methylpiperidin-1-yl)methyl]phenyl]methyl]-4-oxidanylidene-3-propan-2-yl-phthalazine-1-carboxamide Openeye Name: 3-isopropyl-N-[[4-[(2-methyl-1-piperidyl)methyl]phenyl]methyl]-4-oxo-phthalazine-1-carboxamide CAS Name: N-[[4-[(2-methyl-1-piperidinyl)methyl]phenyl]methyl]-4-oxo-3-propan-2-yl-1-phthalazinecarboxamide IUPAC Name: N-[[4-[(2-methylpiperidin-1-yl)methyl]phenyl]methyl]-4-oxo-3-propan-2-ylphthalazine-1-carboxamide Traditional Name: 3-isopropyl-4-keto-N-[4-[(2-methylpiperidino)methyl]benzyl]phthalazine-1-carboxamide Formula: C26H32N4O2 MolecularWeight: 432.55788

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCCCN1CC2=CC=C(C=C2)CNC(=O)C3=NN(C(=O)C4=CC=CC=C43)C(C)C

Isomeric SMILES

CC1CCCCN1CC2=CC=C(C=C2)CNC(=O)C3=NN(C(=O)C4=CC=CC=C43)C(C)C

InChI

InChI=1S/C26H32N4O2/c1-18(2)30-26(32)23-10-5-4-9-22(23)24(28-30)25(31)27-16-20-11-13-21(14-12-20)17-29-15-7-6-8-19(29)3/h4-5,9-14,18-19H,6-8,15-17H2,1-3H3,(H,27,31)