2-[2-(2-methoxyphenyl)-5-sulfanylidene-cyclohexa-1,3-dien-1-yl]-1H-1,2,4-triazol-3-one

Systemtic Name: 2-[2-(2-methoxyphenyl)-5-sulfanylidene-cyclohexa-1,3-dien-1-yl]-1H-1,2,4-triazol-3-one Openeye Name: 2-[2-(2-methoxyphenyl)-5-thioxo-cyclohexa-1,3-dien-1-yl]-1H-1,2,4-triazol-3-one CAS Name: 2-[2-(2-methoxyphenyl)-5-sulfanylidene-1-cyclohexa-1,3-dienyl]-1H-1,2,4-triazol-3-one IUPAC Name: 2-[2-(2-methoxyphenyl)-5-sulfanylidenecyclohexa-1,3-dien-1-yl]-1H-1,2,4-triazol-3-one Traditional Name: 2-[2-(2-methoxyphenyl)-5-thioxo-cyclohexa-1,3-dien-1-yl]-1H-1,2,4-triazol-3-one Formula: C15H13N3O2S MolecularWeight: 299.34762

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC=C1C2=C(CC(=S)C=C2)N3C(=O)N=CN3

Isomeric SMILES

COC1=CC=CC=C1C2=C(CC(=S)C=C2)N3C(=O)N=CN3

InChI

InChI=1S/C15H13N3O2S/c1-20-14-5-3-2-4-12(14)11-7-6-10(21)8-13(11)18-15(19)16-9-17-18/h2-7,9H,8H2,1H3,(H,16,17,19)