6-[2-(azepan-1-yl)-2-oxidanylidene-ethyl]sulfanyl-N,N-dimethyl-pyridine-3-sulfonamide

Systemtic Name: 6-[2-(azepan-1-yl)-2-oxidanylidene-ethyl]sulfanyl-N,N-dimethyl-pyridine-3-sulfonamide Openeye Name: 6-[2-(azepan-1-yl)-2-oxo-ethyl]sulfanyl-N,N-dimethyl-pyridine-3-sulfonamide CAS Name: 6-[[2-(1-azepanyl)-2-oxoethyl]thio]-N,N-dimethyl-3-pyridinesulfonamide IUPAC Name: 6-[2-(azepan-1-yl)-2-oxoethyl]sulfanyl-N,N-dimethylpyridine-3-sulfonamide Traditional Name: 6-[[2-(azepan-1-yl)-2-keto-ethyl]thio]-N,N-dimethyl-pyridine-3-sulfonamide Formula: C15H23N3O3S2 MolecularWeight: 357.49142

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Descriptors Computed from Structure

Canonical SMILES:

CN(C)S(=O)(=O)C1=CN=C(C=C1)SCC(=O)N2CCCCCC2

Isomeric SMILES

CN(C)S(=O)(=O)C1=CN=C(C=C1)SCC(=O)N2CCCCCC2

InChI

InChI=1S/C15H23N3O3S2/c1-17(2)23(20,21)13-7-8-14(16-11-13)22-12-15(19)18-9-5-3-4-6-10-18/h7-8,11H,3-6,9-10,12H2,1-2H3