3-[4-(3-methoxyphenyl)-5-(2-oxidanylidenecyclohexyl)sulfanyl-1,2,4-triazol-3-yl]-N,N-dimethyl-benzenesulfonamide

Systemtic Name: 3-[4-(3-methoxyphenyl)-5-(2-oxidanylidenecyclohexyl)sulfanyl-1,2,4-triazol-3-yl]-N,N-dimethyl-benzenesulfonamide Openeye Name: 3-[4-(3-methoxyphenyl)-5-(2-oxocyclohexyl)sulfanyl-1,2,4-triazol-3-yl]-N,N-dimethyl-benzenesulfonamide CAS Name: 3-[4-(3-methoxyphenyl)-5-[(2-oxocyclohexyl)thio]-1,2,4-triazol-3-yl]-N,N-dimethylbenzenesulfonamide IUPAC Name: 3-[4-(3-methoxyphenyl)-5-(2-oxocyclohexyl)sulfanyl-1,2,4-triazol-3-yl]-N,N-dimethylbenzenesulfonamide Traditional Name: 3-[5-[(2-ketocyclohexyl)thio]-4-(3-methoxyphenyl)-1,2,4-triazol-3-yl]-N,N-dimethyl-benzenesulfonamide Formula: C23H26N4O4S2 MolecularWeight: 486.60694

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Descriptors Computed from Structure

Canonical SMILES:

CN(C)S(=O)(=O)C1=CC=CC(=C1)C2=NN=C(N2C3=CC(=CC=C3)OC)SC4CCCCC4=O

Isomeric SMILES

CN(C)S(=O)(=O)C1=CC=CC(=C1)C2=NN=C(N2C3=CC(=CC=C3)OC)SC4CCCCC4=O

InChI

InChI=1S/C23H26N4O4S2/c1-26(2)33(29,30)19-11-6-8-16(14-19)22-24-25-23(32-21-13-5-4-12-20(21)28)27(22)17-9-7-10-18(15-17)31-3/h6-11,14-15,21H,4-5,12-13H2,1-3H3