3-[(1,5-dimethyl-3-oxidanylidene-2-phenyl-pyrazol-4-yl)sulfamoyl]-N-methyl-N-(1-methylpiperidin-1-ium-4-yl)benzamide

Systemtic Name: 3-[(1,5-dimethyl-3-oxidanylidene-2-phenyl-pyrazol-4-yl)sulfamoyl]-N-methyl-N-(1-methylpiperidin-1-ium-4-yl)benzamide Openeye Name: 3-[(1,5-dimethyl-3-oxo-2-phenyl-pyrazol-4-yl)sulfamoyl]-N-methyl-N-(1-methylpiperidin-1-ium-4-yl)benzamide CAS Name: 3-[(1,5-dimethyl-3-oxo-2-phenyl-4-pyrazolyl)sulfamoyl]-N-methyl-N-(1-methyl-4-piperidin-1-iumyl)benzamide IUPAC Name: 3-[(1,5-dimethyl-3-oxo-2-phenylpyrazol-4-yl)sulfamoyl]-N-methyl-N-(1-methylpiperidin-1-ium-4-yl)benzamide Traditional Name: 3-[(3-keto-1,5-dimethyl-2-phenyl-3-pyrazolin-4-yl)sulfamoyl]-N-methyl-N-(1-methylpiperidin-1-ium-4-yl)benzamide Formula: C25H32N5O4S+ MolecularWeight: 498.61768

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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=CC(=C3)C(=O)N(C)C4CC[NH+](CC4)C

Isomeric SMILES

CC1=C(C(=O)N(N1C)C2=CC=CC=C2)NS(=O)(=O)C3=CC=CC(=C3)C(=O)N(C)C4CC[NH+](CC4)C

InChI

InChI=1S/C25H31N5O4S/c1-18-23(25(32)30(29(18)4)21-10-6-5-7-11-21)26-35(33,34)22-12-8-9-19(17-22)24(31)28(3)20-13-15-27(2)16-14-20/h5-12,17,20,26H,13-16H2,1-4H3/p+1