N-[(E)-(3-methyl-1-phenyl-butylidene)amino]-4-oxidanylidene-3-(phenylmethyl)phthalazine-1-carboxamide

Systemtic Name: N-[(E)-(3-methyl-1-phenyl-butylidene)amino]-4-oxidanylidene-3-(phenylmethyl)phthalazine-1-carboxamide Openeye Name: 3-benzyl-N-[(E)-(3-methyl-1-phenyl-butylidene)amino]-4-oxo-phthalazine-1-carboxamide CAS Name: N-[(E)-(3-methyl-1-phenylbutylidene)amino]-4-oxo-3-(phenylmethyl)-1-phthalazinecarboxamide IUPAC Name: 3-benzyl-N-[(E)-(3-methyl-1-phenylbutylidene)amino]-4-oxophthalazine-1-carboxamide Traditional Name: 3-benzyl-4-keto-N-[(E)-(3-methyl-1-phenyl-butylidene)amino]phthalazine-1-carboxamide Formula: C27H26N4O2 MolecularWeight: 438.52094

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CC(=NNC(=O)C1=NN(C(=O)C2=CC=CC=C21)CC3=CC=CC=C3)C4=CC=CC=C4

Isomeric SMILES

CC(C)C/C(=N\NC(=O)C1=NN(C(=O)C2=CC=CC=C21)CC3=CC=CC=C3)/C4=CC=CC=C4

InChI

InChI=1S/C27H26N4O2/c1-19(2)17-24(21-13-7-4-8-14-21)28-29-26(32)25-22-15-9-10-16-23(22)27(33)31(30-25)18-20-11-5-3-6-12-20/h3-16,19H,17-18H2,1-2H3,(H,29,32)/b28-24+