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

Systemtic Name: N-[3-methyl-4-(2-oxidanylidenepyrrolidin-1-yl)phenyl]-4-oxidanylidene-3-phenyl-phthalazine-1-carboxamide Openeye Name: N-[3-methyl-4-(2-oxopyrrolidin-1-yl)phenyl]-4-oxo-3-phenyl-phthalazine-1-carboxamide CAS Name: N-[3-methyl-4-(2-oxo-1-pyrrolidinyl)phenyl]-4-oxo-3-phenyl-1-phthalazinecarboxamide IUPAC Name: N-[3-methyl-4-(2-oxopyrrolidin-1-yl)phenyl]-4-oxo-3-phenylphthalazine-1-carboxamide Traditional Name: 4-keto-N-[4-(2-ketopyrrolidino)-3-methyl-phenyl]-3-phenyl-phthalazine-1-carboxamide Formula: C26H22N4O3 MolecularWeight: 438.47788

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1)NC(=O)C2=NN(C(=O)C3=CC=CC=C32)C4=CC=CC=C4)N5CCCC5=O

Isomeric SMILES

CC1=C(C=CC(=C1)NC(=O)C2=NN(C(=O)C3=CC=CC=C32)C4=CC=CC=C4)N5CCCC5=O

InChI

InChI=1S/C26H22N4O3/c1-17-16-18(13-14-22(17)29-15-7-12-23(29)31)27-25(32)24-20-10-5-6-11-21(20)26(33)30(28-24)19-8-3-2-4-9-19/h2-6,8-11,13-14,16H,7,12,15H2,1H3,(H,27,32)