2-[[4-ethyl-5-(4-methoxyphenyl)-1,2,4-triazol-3-yl]sulfanyl]-N-(3-ethylphenyl)ethanamide

Systemtic Name: 2-[[4-ethyl-5-(4-methoxyphenyl)-1,2,4-triazol-3-yl]sulfanyl]-N-(3-ethylphenyl)ethanamide Openeye Name: 2-[[4-ethyl-5-(4-methoxyphenyl)-1,2,4-triazol-3-yl]sulfanyl]-N-(3-ethylphenyl)acetamide CAS Name: 2-[[4-ethyl-5-(4-methoxyphenyl)-1,2,4-triazol-3-yl]thio]-N-(3-ethylphenyl)acetamide IUPAC Name: 2-[[4-ethyl-5-(4-methoxyphenyl)-1,2,4-triazol-3-yl]sulfanyl]-N-(3-ethylphenyl)acetamide Traditional Name: 2-[[4-ethyl-5-(4-methoxyphenyl)-1,2,4-triazol-3-yl]thio]-N-(3-ethylphenyl)acetamide Formula: C21H24N4O2S MolecularWeight: 396.50586

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC(=CC=C1)NC(=O)CSC2=NN=C(N2CC)C3=CC=C(C=C3)OC

Isomeric SMILES

CCC1=CC(=CC=C1)NC(=O)CSC2=NN=C(N2CC)C3=CC=C(C=C3)OC

InChI

InChI=1S/C21H24N4O2S/c1-4-15-7-6-8-17(13-15)22-19(26)14-28-21-24-23-20(25(21)5-2)16-9-11-18(27-3)12-10-16/h6-13H,4-5,14H2,1-3H3,(H,22,26)