3-(azepan-1-ylcarbonyl)-N-(1,5-dimethyl-3-oxidanylidene-2-phenyl-pyrazol-4-yl)-4-methoxy-benzenesulfonamide

Systemtic Name: 3-(azepan-1-ylcarbonyl)-N-(1,5-dimethyl-3-oxidanylidene-2-phenyl-pyrazol-4-yl)-4-methoxy-benzenesulfonamide Openeye Name: 3-(azepane-1-carbonyl)-N-(1,5-dimethyl-3-oxo-2-phenyl-pyrazol-4-yl)-4-methoxy-benzenesulfonamide CAS Name: 3-[1-azepanyl(oxo)methyl]-N-(1,5-dimethyl-3-oxo-2-phenyl-4-pyrazolyl)-4-methoxybenzenesulfonamide IUPAC Name: 3-(azepane-1-carbonyl)-N-(1,5-dimethyl-3-oxo-2-phenylpyrazol-4-yl)-4-methoxybenzenesulfonamide Traditional Name: 3-(azepane-1-carbonyl)-N-(3-keto-1,5-dimethyl-2-phenyl-3-pyrazolin-4-yl)-4-methoxy-benzenesulfonamide Formula: C25H30N4O5S MolecularWeight: 498.5945

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=O)N(N1C)C2=CC=CC=C2)NS(=O)(=O)C3=CC(=C(C=C3)OC)C(=O)N4CCCCCC4

Isomeric SMILES

CC1=C(C(=O)N(N1C)C2=CC=CC=C2)NS(=O)(=O)C3=CC(=C(C=C3)OC)C(=O)N4CCCCCC4

InChI

InChI=1S/C25H30N4O5S/c1-18-23(25(31)29(27(18)2)19-11-7-6-8-12-19)26-35(32,33)20-13-14-22(34-3)21(17-20)24(30)28-15-9-4-5-10-16-28/h6-8,11-14,17,26H,4-5,9-10,15-16H2,1-3H3