N-[2-methyl-3-(methylcarbamoyl)phenyl]-4-oxidanylidene-3-(phenylmethyl)phthalazine-1-carboxamide

Systemtic Name: N-[2-methyl-3-(methylcarbamoyl)phenyl]-4-oxidanylidene-3-(phenylmethyl)phthalazine-1-carboxamide Openeye Name: 3-benzyl-N-[2-methyl-3-(methylcarbamoyl)phenyl]-4-oxo-phthalazine-1-carboxamide CAS Name: N-[2-methyl-3-(methylcarbamoyl)phenyl]-4-oxo-3-(phenylmethyl)-1-phthalazinecarboxamide IUPAC Name: 3-benzyl-N-[2-methyl-3-(methylcarbamoyl)phenyl]-4-oxophthalazine-1-carboxamide Traditional Name: 3-benzyl-4-keto-N-[2-methyl-3-(methylcarbamoyl)phenyl]phthalazine-1-carboxamide Formula: C25H22N4O3 MolecularWeight: 426.46718

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC=C1NC(=O)C2=NN(C(=O)C3=CC=CC=C32)CC4=CC=CC=C4)C(=O)NC

Isomeric SMILES

CC1=C(C=CC=C1NC(=O)C2=NN(C(=O)C3=CC=CC=C32)CC4=CC=CC=C4)C(=O)NC

InChI

InChI=1S/C25H22N4O3/c1-16-18(23(30)26-2)13-8-14-21(16)27-24(31)22-19-11-6-7-12-20(19)25(32)29(28-22)15-17-9-4-3-5-10-17/h3-14H,15H2,1-2H3,(H,26,30)(H,27,31)