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

Systemtic Name: 4-[[1-(4-bromophenyl)-3-methyl-5-oxidanylidene-pyrazol-4-ylidene]methylamino]-N-(4-ethoxyphenyl)benzenesulfonamide Openeye Name: 4-[[1-(4-bromophenyl)-3-methyl-5-oxo-pyrazol-4-ylidene]methylamino]-N-(4-ethoxyphenyl)benzenesulfonamide CAS Name: 4-[[1-(4-bromophenyl)-3-methyl-5-oxo-4-pyrazolylidene]methylamino]-N-(4-ethoxyphenyl)benzenesulfonamide IUPAC Name: 4-[[1-(4-bromophenyl)-3-methyl-5-oxopyrazol-4-ylidene]methylamino]-N-(4-ethoxyphenyl)benzenesulfonamide Traditional Name: 4-[[1-(4-bromophenyl)-5-keto-3-methyl-2-pyrazolin-4-ylidene]methylamino]-N-p-phenetyl-benzenesulfonamide Formula: C25H23BrN4O4S MolecularWeight: 555.44352

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=C(C=C1)NS(=O)(=O)C2=CC=C(C=C2)NC=C3C(=NN(C3=O)C4=CC=C(C=C4)Br)C

Isomeric SMILES

CCOC1=CC=C(C=C1)NS(=O)(=O)C2=CC=C(C=C2)NC=C3C(=NN(C3=O)C4=CC=C(C=C4)Br)C

InChI

InChI=1S/C25H23BrN4O4S/c1-3-34-22-12-6-20(7-13-22)29-35(32,33)23-14-8-19(9-15-23)27-16-24-17(2)28-30(25(24)31)21-10-4-18(26)5-11-21/h4-16,27,29H,3H2,1-2H3