4-[[1-(4-bromophenyl)-3-methyl-5-oxidanylidene-pyrazol-4-ylidene]methylamino]benzenesulfonamide

Systemtic Name: 4-[[1-(4-bromophenyl)-3-methyl-5-oxidanylidene-pyrazol-4-ylidene]methylamino]benzenesulfonamide Openeye Name: 4-[[1-(4-bromophenyl)-3-methyl-5-oxo-pyrazol-4-ylidene]methylamino]benzenesulfonamide CAS Name: 4-[[1-(4-bromophenyl)-3-methyl-5-oxo-4-pyrazolylidene]methylamino]benzenesulfonamide IUPAC Name: 4-[[1-(4-bromophenyl)-3-methyl-5-oxopyrazol-4-ylidene]methylamino]benzenesulfonamide Traditional Name: 4-[[1-(4-bromophenyl)-5-keto-3-methyl-2-pyrazolin-4-ylidene]methylamino]benzenesulfonamide Formula: C17H15BrN4O3S MolecularWeight: 435.295

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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=C(C=C3)Br

Isomeric SMILES

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

InChI

InChI=1S/C17H15BrN4O3S/c1-11-16(10-20-13-4-8-15(9-5-13)26(19,24)25)17(23)22(21-11)14-6-2-12(18)3-7-14/h2-10,20H,1H3,(H2,19,24,25)