N,N-dimethyl-6-[2-oxidanylidene-2-(5-phenyl-3,4-dihydropyrazol-2-yl)ethyl]sulfanyl-pyridine-3-sulfonamide

Systemtic Name: N,N-dimethyl-6-[2-oxidanylidene-2-(5-phenyl-3,4-dihydropyrazol-2-yl)ethyl]sulfanyl-pyridine-3-sulfonamide Openeye Name: N,N-dimethyl-6-[2-oxo-2-(5-phenyl-3,4-dihydropyrazol-2-yl)ethyl]sulfanyl-pyridine-3-sulfonamide CAS Name: N,N-dimethyl-6-[[2-oxo-2-(5-phenyl-3,4-dihydropyrazol-2-yl)ethyl]thio]-3-pyridinesulfonamide IUPAC Name: N,N-dimethyl-6-[2-oxo-2-(5-phenyl-3,4-dihydropyrazol-2-yl)ethyl]sulfanylpyridine-3-sulfonamide Traditional Name: 6-[[2-keto-2-(3-phenyl-2-pyrazolin-1-yl)ethyl]thio]-N,N-dimethyl-pyridine-3-sulfonamide Formula: C18H20N4O3S2 MolecularWeight: 404.5064

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Descriptors Computed from Structure

Canonical SMILES:

CN(C)S(=O)(=O)C1=CN=C(C=C1)SCC(=O)N2CCC(=N2)C3=CC=CC=C3

Isomeric SMILES

CN(C)S(=O)(=O)C1=CN=C(C=C1)SCC(=O)N2CCC(=N2)C3=CC=CC=C3

InChI

InChI=1S/C18H20N4O3S2/c1-21(2)27(24,25)15-8-9-17(19-12-15)26-13-18(23)22-11-10-16(20-22)14-6-4-3-5-7-14/h3-9,12H,10-11,13H2,1-2H3