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

Systemtic Name: 3-(azepan-1-ylcarbonyl)-N-(1,5-dimethyl-3-oxidanylidene-2-phenyl-pyrazol-4-yl)-N-methyl-benzenesulfonamide Openeye Name: 3-(azepane-1-carbonyl)-N-(1,5-dimethyl-3-oxo-2-phenyl-pyrazol-4-yl)-N-methyl-benzenesulfonamide CAS Name: 3-[1-azepanyl(oxo)methyl]-N-(1,5-dimethyl-3-oxo-2-phenyl-4-pyrazolyl)-N-methylbenzenesulfonamide IUPAC Name: 3-(azepane-1-carbonyl)-N-(1,5-dimethyl-3-oxo-2-phenylpyrazol-4-yl)-N-methylbenzenesulfonamide Traditional Name: 3-(azepane-1-carbonyl)-N-(3-keto-1,5-dimethyl-2-phenyl-3-pyrazolin-4-yl)-N-methyl-benzenesulfonamide Formula: C25H30N4O4S MolecularWeight: 482.5951

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C25H30N4O4S/c1-19-23(25(31)29(26(19)2)21-13-7-6-8-14-21)27(3)34(32,33)22-15-11-12-20(18-22)24(30)28-16-9-4-5-10-17-28/h6-8,11-15,18H,4-5,9-10,16-17H2,1-3H3