4-[[(E)-[1-(3-chlorophenyl)-3-methyl-5-oxidanylidene-pyrazol-4-ylidene]methyl]amino]benzenesulfonamide

Systemtic Name: 4-[[(E)-[1-(3-chlorophenyl)-3-methyl-5-oxidanylidene-pyrazol-4-ylidene]methyl]amino]benzenesulfonamide Openeye Name: 4-[[(E)-[1-(3-chlorophenyl)-3-methyl-5-oxo-pyrazol-4-ylidene]methyl]amino]benzenesulfonamide CAS Name: 4-[[(E)-[1-(3-chlorophenyl)-3-methyl-5-oxo-4-pyrazolylidene]methyl]amino]benzenesulfonamide IUPAC Name: 4-[[(E)-[1-(3-chlorophenyl)-3-methyl-5-oxopyrazol-4-ylidene]methyl]amino]benzenesulfonamide Traditional Name: 4-[[(E)-[1-(3-chlorophenyl)-5-keto-3-methyl-2-pyrazolin-4-ylidene]methyl]amino]benzenesulfonamide Formula: C17H15ClN4O3S MolecularWeight: 390.844

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NN(C(=O)C1=CNC2=CC=C(C=C2)S(=O)(=O)N)C3=CC(=CC=C3)Cl

Isomeric SMILES

CC\1=NN(C(=O)/C1=C/NC2=CC=C(C=C2)S(=O)(=O)N)C3=CC(=CC=C3)Cl

InChI

InChI=1S/C17H15ClN4O3S/c1-11-16(10-20-13-5-7-15(8-6-13)26(19,24)25)17(23)22(21-11)14-4-2-3-12(18)9-14/h2-10,20H,1H3,(H2,19,24,25)/b16-10+