2-[4-[(2-methoxyphenyl)methyl]-5-sulfanylidene-1H-1,2,4-triazol-3-yl]ethanamide

Systemtic Name: 2-[4-[(2-methoxyphenyl)methyl]-5-sulfanylidene-1H-1,2,4-triazol-3-yl]ethanamide Openeye Name: 2-[4-[(2-methoxyphenyl)methyl]-5-thioxo-1H-1,2,4-triazol-3-yl]acetamide CAS Name: 2-[4-[(2-methoxyphenyl)methyl]-5-sulfanylidene-1H-1,2,4-triazol-3-yl]acetamide IUPAC Name: 2-[4-[(2-methoxyphenyl)methyl]-5-sulfanylidene-1H-1,2,4-triazol-3-yl]acetamide Traditional Name: 2-(4-o-anisyl-5-thioxo-1H-1,2,4-triazol-3-yl)acetamide Formula: C12H14N4O2S MolecularWeight: 278.33016

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC=C1CN2C(=NNC2=S)CC(=O)N

Isomeric SMILES

COC1=CC=CC=C1CN2C(=NNC2=S)CC(=O)N

InChI

InChI=1S/C12H14N4O2S/c1-18-9-5-3-2-4-8(9)7-16-11(6-10(13)17)14-15-12(16)19/h2-5H,6-7H2,1H3,(H2,13,17)(H,15,19)