2-[[4-(2-methoxyethyl)-5-phenethyl-1,2,4-triazol-3-yl]sulfanyl]-N-(4-methylphenyl)ethanamide

Systemtic Name: 2-[[4-(2-methoxyethyl)-5-phenethyl-1,2,4-triazol-3-yl]sulfanyl]-N-(4-methylphenyl)ethanamide Openeye Name: 2-[[4-(2-methoxyethyl)-5-phenethyl-1,2,4-triazol-3-yl]sulfanyl]-N-(p-tolyl)acetamide CAS Name: 2-[[4-(2-methoxyethyl)-5-phenethyl-1,2,4-triazol-3-yl]thio]-N-(4-methylphenyl)acetamide IUPAC Name: 2-[[4-(2-methoxyethyl)-5-phenethyl-1,2,4-triazol-3-yl]sulfanyl]-N-(4-methylphenyl)acetamide Traditional Name: 2-[[4-(2-methoxyethyl)-5-phenethyl-1,2,4-triazol-3-yl]thio]-N-(p-tolyl)acetamide Formula: C22H26N4O2S MolecularWeight: 410.53244

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)NC(=O)CSC2=NN=C(N2CCOC)CCC3=CC=CC=C3

Isomeric SMILES

CC1=CC=C(C=C1)NC(=O)CSC2=NN=C(N2CCOC)CCC3=CC=CC=C3

InChI

InChI=1S/C22H26N4O2S/c1-17-8-11-19(12-9-17)23-21(27)16-29-22-25-24-20(26(22)14-15-28-2)13-10-18-6-4-3-5-7-18/h3-9,11-12H,10,13-16H2,1-2H3,(H,23,27)