N-[1-[5-(cyclohexylmethylsulfanyl)-4-methyl-1,2,4-triazol-3-yl]-2-phenyl-ethyl]-2,5-dimethoxy-benzenesulfonamide

Systemtic Name: N-[1-[5-(cyclohexylmethylsulfanyl)-4-methyl-1,2,4-triazol-3-yl]-2-phenyl-ethyl]-2,5-dimethoxy-benzenesulfonamide Openeye Name: N-[1-[5-(cyclohexylmethylsulfanyl)-4-methyl-1,2,4-triazol-3-yl]-2-phenyl-ethyl]-2,5-dimethoxy-benzenesulfonamide CAS Name: N-[1-[5-(cyclohexylmethylthio)-4-methyl-1,2,4-triazol-3-yl]-2-phenylethyl]-2,5-dimethoxybenzenesulfonamide IUPAC Name: N-[1-[5-(cyclohexylmethylsulfanyl)-4-methyl-1,2,4-triazol-3-yl]-2-phenylethyl]-2,5-dimethoxybenzenesulfonamide Traditional Name: N-[1-[5-(cyclohexylmethylthio)-4-methyl-1,2,4-triazol-3-yl]-2-phenyl-ethyl]-2,5-dimethoxy-benzenesulfonamide Formula: C26H34N4O4S2 MolecularWeight: 530.70256

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Descriptors Computed from Structure

Canonical SMILES:

CN1C(=NN=C1SCC2CCCCC2)C(CC3=CC=CC=C3)NS(=O)(=O)C4=C(C=CC(=C4)OC)OC

Isomeric SMILES

CN1C(=NN=C1SCC2CCCCC2)C(CC3=CC=CC=C3)NS(=O)(=O)C4=C(C=CC(=C4)OC)OC

InChI

InChI=1S/C26H34N4O4S2/c1-30-25(27-28-26(30)35-18-20-12-8-5-9-13-20)22(16-19-10-6-4-7-11-19)29-36(31,32)24-17-21(33-2)14-15-23(24)34-3/h4,6-7,10-11,14-15,17,20,22,29H,5,8-9,12-13,16,18H2,1-3H3