(4S)-4-[[(4-bromophenyl)amino]methyl]-5-methyl-2-phenyl-4H-pyrazol-3-one

Systemtic Name: (4S)-4-[[(4-bromophenyl)amino]methyl]-5-methyl-2-phenyl-4H-pyrazol-3-one Openeye Name: (4S)-4-[(4-bromoanilino)methyl]-5-methyl-2-phenyl-4H-pyrazol-3-one CAS Name: (4S)-4-[(4-bromoanilino)methyl]-5-methyl-2-phenyl-4H-pyrazol-3-one IUPAC Name: (4S)-4-[(4-bromoanilino)methyl]-5-methyl-2-phenyl-4H-pyrazol-3-one Traditional Name: (4S)-4-[(4-bromoanilino)methyl]-5-methyl-2-phenyl-2-pyrazolin-3-one Formula: C17H16BrN3O MolecularWeight: 358.23244

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NN(C(=O)C1CNC2=CC=C(C=C2)Br)C3=CC=CC=C3

Isomeric SMILES

CC1=NN(C(=O)[C@H]1CNC2=CC=C(C=C2)Br)C3=CC=CC=C3

InChI

InChI=1S/C17H16BrN3O/c1-12-16(11-19-14-9-7-13(18)8-10-14)17(22)21(20-12)15-5-3-2-4-6-15/h2-10,16,19H,11H2,1H3/t16-/m0/s1