N-[[4-(diethylaminomethyl)phenyl]methyl]-3-(2-methylpropyl)-4-oxidanylidene-phthalazine-1-carboxamide

Systemtic Name: N-[[4-(diethylaminomethyl)phenyl]methyl]-3-(2-methylpropyl)-4-oxidanylidene-phthalazine-1-carboxamide Openeye Name: N-[[4-(diethylaminomethyl)phenyl]methyl]-3-isobutyl-4-oxo-phthalazine-1-carboxamide CAS Name: N-[[4-(diethylaminomethyl)phenyl]methyl]-3-(2-methylpropyl)-4-oxo-1-phthalazinecarboxamide IUPAC Name: N-[[4-(diethylaminomethyl)phenyl]methyl]-3-(2-methylpropyl)-4-oxophthalazine-1-carboxamide Traditional Name: N-[4-(diethylaminomethyl)benzyl]-3-isobutyl-4-keto-phthalazine-1-carboxamide Formula: C25H32N4O2 MolecularWeight: 420.54718

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)CC1=CC=C(C=C1)CNC(=O)C2=NN(C(=O)C3=CC=CC=C32)CC(C)C

Isomeric SMILES

CCN(CC)CC1=CC=C(C=C1)CNC(=O)C2=NN(C(=O)C3=CC=CC=C32)CC(C)C

InChI

InChI=1S/C25H32N4O2/c1-5-28(6-2)17-20-13-11-19(12-14-20)15-26-24(30)23-21-9-7-8-10-22(21)25(31)29(27-23)16-18(3)4/h7-14,18H,5-6,15-17H2,1-4H3,(H,26,30)