4-[4-(4-methoxyphenyl)-5-sulfanylidene-1,2,4-triazolidin-3-ylidene]cyclohexa-2,5-dien-1-one

Systemtic Name: 4-[4-(4-methoxyphenyl)-5-sulfanylidene-1,2,4-triazolidin-3-ylidene]cyclohexa-2,5-dien-1-one Openeye Name: 4-[4-(4-methoxyphenyl)-5-thioxo-1,2,4-triazolidin-3-ylidene]cyclohexa-2,5-dien-1-one CAS Name: 4-[4-(4-methoxyphenyl)-5-sulfanylidene-1,2,4-triazolidin-3-ylidene]-1-cyclohexa-2,5-dienone IUPAC Name: 4-[4-(4-methoxyphenyl)-5-sulfanylidene-1,2,4-triazolidin-3-ylidene]cyclohexa-2,5-dien-1-one Traditional Name: 4-[4-(4-methoxyphenyl)-5-thioxo-1,2,4-triazolidin-3-ylidene]cyclohexa-2,5-dien-1-one Formula: C15H13N3O2S MolecularWeight: 299.34762

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)N2C(=C3C=CC(=O)C=C3)NNC2=S

Isomeric SMILES

COC1=CC=C(C=C1)N2C(=C3C=CC(=O)C=C3)NNC2=S

InChI

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