2-[[4-cyclohexyl-5-(2-methoxyphenyl)-1,2,4-triazol-3-yl]sulfanyl]-2-phenyl-ethanamide

Systemtic Name: 2-[[4-cyclohexyl-5-(2-methoxyphenyl)-1,2,4-triazol-3-yl]sulfanyl]-2-phenyl-ethanamide Openeye Name: 2-[[4-cyclohexyl-5-(2-methoxyphenyl)-1,2,4-triazol-3-yl]sulfanyl]-2-phenyl-acetamide CAS Name: 2-[[4-cyclohexyl-5-(2-methoxyphenyl)-1,2,4-triazol-3-yl]thio]-2-phenylacetamide IUPAC Name: 2-[[4-cyclohexyl-5-(2-methoxyphenyl)-1,2,4-triazol-3-yl]sulfanyl]-2-phenylacetamide Traditional Name: 2-[[4-cyclohexyl-5-(2-methoxyphenyl)-1,2,4-triazol-3-yl]thio]-2-phenyl-acetamide Formula: C23H26N4O2S MolecularWeight: 422.54314

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC=C1C2=NN=C(N2C3CCCCC3)SC(C4=CC=CC=C4)C(=O)N

Isomeric SMILES

COC1=CC=CC=C1C2=NN=C(N2C3CCCCC3)SC(C4=CC=CC=C4)C(=O)N

InChI

InChI=1S/C23H26N4O2S/c1-29-19-15-9-8-14-18(19)22-25-26-23(27(22)17-12-6-3-7-13-17)30-20(21(24)28)16-10-4-2-5-11-16/h2,4-5,8-11,14-15,17,20H,3,6-7,12-13H2,1H3,(H2,24,28)