N-cyclohexyl-4-[3-(2-oxidanylidene-2-pyrrolidin-1-yl-ethyl)sulfanyl-1H-1,2,4-triazol-5-yl]benzenesulfonamide

Systemtic Name: N-cyclohexyl-4-[3-(2-oxidanylidene-2-pyrrolidin-1-yl-ethyl)sulfanyl-1H-1,2,4-triazol-5-yl]benzenesulfonamide Openeye Name: N-cyclohexyl-4-[3-(2-oxo-2-pyrrolidin-1-yl-ethyl)sulfanyl-1H-1,2,4-triazol-5-yl]benzenesulfonamide CAS Name: N-cyclohexyl-4-[3-[[2-oxo-2-(1-pyrrolidinyl)ethyl]thio]-1H-1,2,4-triazol-5-yl]benzenesulfonamide IUPAC Name: N-cyclohexyl-4-[3-(2-oxo-2-pyrrolidin-1-ylethyl)sulfanyl-1H-1,2,4-triazol-5-yl]benzenesulfonamide Traditional Name: N-cyclohexyl-4-[3-[(2-keto-2-pyrrolidino-ethyl)thio]-1H-1,2,4-triazol-5-yl]benzenesulfonamide Formula: C20H27N5O3S2 MolecularWeight: 449.59008

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(CC1)NS(=O)(=O)C2=CC=C(C=C2)C3=NC(=NN3)SCC(=O)N4CCCC4

Isomeric SMILES

C1CCC(CC1)NS(=O)(=O)C2=CC=C(C=C2)C3=NC(=NN3)SCC(=O)N4CCCC4

InChI

InChI=1S/C20H27N5O3S2/c26-18(25-12-4-5-13-25)14-29-20-21-19(22-23-20)15-8-10-17(11-9-15)30(27,28)24-16-6-2-1-3-7-16/h8-11,16,24H,1-7,12-14H2,(H,21,22,23)