1-[(4-methoxyphenyl)methyl]-N-[(3-methylsulfanylphenyl)methyl]-1,2,3-triazole-4-carboxamide

Systemtic Name: 1-[(4-methoxyphenyl)methyl]-N-[(3-methylsulfanylphenyl)methyl]-1,2,3-triazole-4-carboxamide Openeye Name: 1-[(4-methoxyphenyl)methyl]-N-[(3-methylsulfanylphenyl)methyl]triazole-4-carboxamide CAS Name: 1-[(4-methoxyphenyl)methyl]-N-[[3-(methylthio)phenyl]methyl]-4-triazolecarboxamide IUPAC Name: 1-[(4-methoxyphenyl)methyl]-N-[(3-methylsulfanylphenyl)methyl]triazole-4-carboxamide Traditional Name: N-[3-(methylthio)benzyl]-1-p-anisyl-triazole-4-carboxamide Formula: C19H20N4O2S MolecularWeight: 368.4527

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)CN2C=C(N=N2)C(=O)NCC3=CC(=CC=C3)SC

Isomeric SMILES

COC1=CC=C(C=C1)CN2C=C(N=N2)C(=O)NCC3=CC(=CC=C3)SC

InChI

InChI=1S/C19H20N4O2S/c1-25-16-8-6-14(7-9-16)12-23-13-18(21-22-23)19(24)20-11-15-4-3-5-17(10-15)26-2/h3-10,13H,11-12H2,1-2H3,(H,20,24)