N-[[4-(4-methoxyphenyl)-5-methylsulfanyl-1,2,4-triazol-3-yl]methyl]-2-thiophen-3-yl-ethanamide

Systemtic Name: N-[[4-(4-methoxyphenyl)-5-methylsulfanyl-1,2,4-triazol-3-yl]methyl]-2-thiophen-3-yl-ethanamide Openeye Name: N-[[4-(4-methoxyphenyl)-5-methylsulfanyl-1,2,4-triazol-3-yl]methyl]-2-(3-thienyl)acetamide CAS Name: N-[[4-(4-methoxyphenyl)-5-(methylthio)-1,2,4-triazol-3-yl]methyl]-2-(3-thiophenyl)acetamide IUPAC Name: N-[[4-(4-methoxyphenyl)-5-methylsulfanyl-1,2,4-triazol-3-yl]methyl]-2-thiophen-3-ylacetamide Traditional Name: N-[[4-(4-methoxyphenyl)-5-(methylthio)-1,2,4-triazol-3-yl]methyl]-2-(3-thienyl)acetamide Formula: C17H18N4O2S2 MolecularWeight: 374.48042

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)N2C(=NN=C2SC)CNC(=O)CC3=CSC=C3

Isomeric SMILES

COC1=CC=C(C=C1)N2C(=NN=C2SC)CNC(=O)CC3=CSC=C3

InChI

InChI=1S/C17H18N4O2S2/c1-23-14-5-3-13(4-6-14)21-15(19-20-17(21)24-2)10-18-16(22)9-12-7-8-25-11-12/h3-8,11H,9-10H2,1-2H3,(H,18,22)