1,5-dimethyl-2-phenyl-4-[[7-(phenylmethyl)iminocyclohepta-1,3,5-trien-1-yl]amino]pyrazol-3-one

Systemtic Name: 1,5-dimethyl-2-phenyl-4-[[7-(phenylmethyl)iminocyclohepta-1,3,5-trien-1-yl]amino]pyrazol-3-one Openeye Name: 4-[(7-benzyliminocyclohepta-1,3,5-trien-1-yl)amino]-1,5-dimethyl-2-phenyl-pyrazol-3-one CAS Name: 1,5-dimethyl-2-phenyl-4-[[7-(phenylmethyl)imino-1-cyclohepta-1,3,5-trienyl]amino]-3-pyrazolone IUPAC Name: 4-[(7-benzyliminocyclohepta-1,3,5-trien-1-yl)amino]-1,5-dimethyl-2-phenylpyrazol-3-one Traditional Name: 4-[(7-benzyliminocyclohepta-1,3,5-trien-1-yl)amino]-1,5-dimethyl-2-phenyl-3-pyrazolin-3-one Formula: C25H24N4O MolecularWeight: 396.48426

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=O)N(N1C)C2=CC=CC=C2)NC3=CC=CC=CC3=NCC4=CC=CC=C4

Isomeric SMILES

CC1=C(C(=O)N(N1C)C2=CC=CC=C2)NC3=CC=CC=CC3=NCC4=CC=CC=C4

InChI

InChI=1S/C25H24N4O/c1-19-24(25(30)29(28(19)2)21-14-8-4-9-15-21)27-23-17-11-5-10-16-22(23)26-18-20-12-6-3-7-13-20/h3-17H,18H2,1-2H3,(H,26,27)