N-[[4-(4-methoxyphenyl)-5-methylsulfanyl-1,2,4-triazol-3-yl]methyl]-2,3-dihydro-1-benzofuran-2-carboxamide

Systemtic Name: N-[[4-(4-methoxyphenyl)-5-methylsulfanyl-1,2,4-triazol-3-yl]methyl]-2,3-dihydro-1-benzofuran-2-carboxamide Openeye Name: N-[[4-(4-methoxyphenyl)-5-methylsulfanyl-1,2,4-triazol-3-yl]methyl]-2,3-dihydrobenzofuran-2-carboxamide CAS Name: N-[[4-(4-methoxyphenyl)-5-(methylthio)-1,2,4-triazol-3-yl]methyl]-2,3-dihydrobenzofuran-2-carboxamide IUPAC Name: N-[[4-(4-methoxyphenyl)-5-methylsulfanyl-1,2,4-triazol-3-yl]methyl]-2,3-dihydro-1-benzofuran-2-carboxamide Traditional Name: N-[[4-(4-methoxyphenyl)-5-(methylthio)-1,2,4-triazol-3-yl]methyl]coumaran-2-carboxamide Formula: C20H20N4O3S MolecularWeight: 396.4628

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)N2C(=NN=C2SC)CNC(=O)C3CC4=CC=CC=C4O3

Isomeric SMILES

COC1=CC=C(C=C1)N2C(=NN=C2SC)CNC(=O)C3CC4=CC=CC=C4O3

InChI

InChI=1S/C20H20N4O3S/c1-26-15-9-7-14(8-10-15)24-18(22-23-20(24)28-2)12-21-19(25)17-11-13-5-3-4-6-16(13)27-17/h3-10,17H,11-12H2,1-2H3,(H,21,25)