4-[[(4S)-3-methyl-5-oxidanylidene-1-phenyl-4H-pyrazol-4-yl]diazenyl]benzenesulfonamide

Systemtic Name: 4-[[(4S)-3-methyl-5-oxidanylidene-1-phenyl-4H-pyrazol-4-yl]diazenyl]benzenesulfonamide Openeye Name: 4-[[(4S)-3-methyl-5-oxo-1-phenyl-4H-pyrazol-4-yl]azo]benzenesulfonamide CAS Name: 4-[[(4S)-3-methyl-5-oxo-1-phenyl-4H-pyrazol-4-yl]azo]benzenesulfonamide IUPAC Name: 4-[[(4S)-3-methyl-5-oxo-1-phenyl-4H-pyrazol-4-yl]diazenyl]benzenesulfonamide Traditional Name: 4-[[(4S)-5-keto-3-methyl-1-phenyl-2-pyrazolin-4-yl]azo]benzenesulfonamide Formula: C16H15N5O3S MolecularWeight: 357.387

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=NN(C(=O)C1N=NC2=CC=C(C=C2)S(=O)(=O)N)C3=CC=CC=C3

Isomeric SMILES

CC1=NN(C(=O)[C@H]1N=NC2=CC=C(C=C2)S(=O)(=O)N)C3=CC=CC=C3

InChI

InChI=1S/C16H15N5O3S/c1-11-15(16(22)21(20-11)13-5-3-2-4-6-13)19-18-12-7-9-14(10-8-12)25(17,23)24/h2-10,15H,1H3,(H2,17,23,24)/t15-/m0/s1