2-[(4-cyclohexyl-5-thiophen-2-yl-1,2,4-triazol-3-yl)sulfanyl]-N-(2,5-dimethoxyphenyl)ethanamide

Systemtic Name: 2-[(4-cyclohexyl-5-thiophen-2-yl-1,2,4-triazol-3-yl)sulfanyl]-N-(2,5-dimethoxyphenyl)ethanamide Openeye Name: 2-[[4-cyclohexyl-5-(2-thienyl)-1,2,4-triazol-3-yl]sulfanyl]-N-(2,5-dimethoxyphenyl)acetamide CAS Name: 2-[(4-cyclohexyl-5-thiophen-2-yl-1,2,4-triazol-3-yl)thio]-N-(2,5-dimethoxyphenyl)acetamide IUPAC Name: 2-[(4-cyclohexyl-5-thiophen-2-yl-1,2,4-triazol-3-yl)sulfanyl]-N-(2,5-dimethoxyphenyl)acetamide Traditional Name: 2-[[4-cyclohexyl-5-(2-thienyl)-1,2,4-triazol-3-yl]thio]-N-(2,5-dimethoxyphenyl)acetamide Formula: C22H26N4O3S2 MolecularWeight: 458.59684

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=C(C=C1)OC)NC(=O)CSC2=NN=C(N2C3CCCCC3)C4=CC=CS4

Isomeric SMILES

COC1=CC(=C(C=C1)OC)NC(=O)CSC2=NN=C(N2C3CCCCC3)C4=CC=CS4

InChI

InChI=1S/C22H26N4O3S2/c1-28-16-10-11-18(29-2)17(13-16)23-20(27)14-31-22-25-24-21(19-9-6-12-30-19)26(22)15-7-4-3-5-8-15/h6,9-13,15H,3-5,7-8,14H2,1-2H3,(H,23,27)