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

Systemtic Name: 2-[[4-methyl-5-(2-methylphenyl)-1,2,4-triazol-3-yl]sulfanyl]-N-(2-propoxyphenyl)ethanamide Openeye Name: 2-[[4-methyl-5-(o-tolyl)-1,2,4-triazol-3-yl]sulfanyl]-N-(2-propoxyphenyl)acetamide CAS Name: 2-[[4-methyl-5-(2-methylphenyl)-1,2,4-triazol-3-yl]thio]-N-(2-propoxyphenyl)acetamide IUPAC Name: 2-[[4-methyl-5-(2-methylphenyl)-1,2,4-triazol-3-yl]sulfanyl]-N-(2-propoxyphenyl)acetamide Traditional Name: 2-[[4-methyl-5-(o-tolyl)-1,2,4-triazol-3-yl]thio]-N-(2-propoxyphenyl)acetamide Formula: C21H24N4O2S MolecularWeight: 396.50586

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Descriptors Computed from Structure

Canonical SMILES:

CCCOC1=CC=CC=C1NC(=O)CSC2=NN=C(N2C)C3=CC=CC=C3C

Isomeric SMILES

CCCOC1=CC=CC=C1NC(=O)CSC2=NN=C(N2C)C3=CC=CC=C3C

InChI

InChI=1S/C21H24N4O2S/c1-4-13-27-18-12-8-7-11-17(18)22-19(26)14-28-21-24-23-20(25(21)3)16-10-6-5-9-15(16)2/h5-12H,4,13-14H2,1-3H3,(H,22,26)