(4S)-5-methyl-4-[(1S)-3-oxidanylidene-1,3-diphenyl-propyl]-2-phenyl-4H-pyrazol-3-one

Systemtic Name: (4S)-5-methyl-4-[(1S)-3-oxidanylidene-1,3-diphenyl-propyl]-2-phenyl-4H-pyrazol-3-one Openeye Name: (4S)-5-methyl-4-[(1S)-3-oxo-1,3-diphenyl-propyl]-2-phenyl-4H-pyrazol-3-one CAS Name: (4S)-5-methyl-4-[(1S)-3-oxo-1,3-diphenylpropyl]-2-phenyl-4H-pyrazol-3-one IUPAC Name: (4S)-5-methyl-4-[(1S)-3-oxo-1,3-diphenylpropyl]-2-phenyl-4H-pyrazol-3-one Traditional Name: (4S)-4-[(1S)-3-keto-1,3-diphenyl-propyl]-5-methyl-2-phenyl-2-pyrazolin-3-one Formula: C25H22N2O2 MolecularWeight: 382.45438

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NN(C(=O)C1C(CC(=O)C2=CC=CC=C2)C3=CC=CC=C3)C4=CC=CC=C4

Isomeric SMILES

CC1=NN(C(=O)[C@H]1[C@H](CC(=O)C2=CC=CC=C2)C3=CC=CC=C3)C4=CC=CC=C4

InChI

InChI=1S/C25H22N2O2/c1-18-24(25(29)27(26-18)21-15-9-4-10-16-21)22(19-11-5-2-6-12-19)17-23(28)20-13-7-3-8-14-20/h2-16,22,24H,17H2,1H3/t22-,24-/m1/s1