(6Z)-6-[4-(1-benzofuran-5-yl)-5-sulfanylidene-1,2,4-triazolidin-3-ylidene]-4-ethyl-3-oxidanyl-cyclohexa-2,4-dien-1-one

Systemtic Name: (6Z)-6-[4-(1-benzofuran-5-yl)-5-sulfanylidene-1,2,4-triazolidin-3-ylidene]-4-ethyl-3-oxidanyl-cyclohexa-2,4-dien-1-one Openeye Name: (6Z)-6-[4-(benzofuran-5-yl)-5-thioxo-1,2,4-triazolidin-3-ylidene]-4-ethyl-3-hydroxy-cyclohexa-2,4-dien-1-one CAS Name: (6Z)-6-[4-(5-benzofuranyl)-5-sulfanylidene-1,2,4-triazolidin-3-ylidene]-4-ethyl-3-hydroxy-1-cyclohexa-2,4-dienone IUPAC Name: (6Z)-6-[4-(1-benzofuran-5-yl)-5-sulfanylidene-1,2,4-triazolidin-3-ylidene]-4-ethyl-3-hydroxycyclohexa-2,4-dien-1-one Traditional Name: (6Z)-6-[4-(benzofuran-5-yl)-5-thioxo-1,2,4-triazolidin-3-ylidene]-4-ethyl-3-hydroxy-cyclohexa-2,4-dien-1-one Formula: C18H15N3O3S MolecularWeight: 353.395

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC(=C2NNC(=S)N2C3=CC4=C(C=C3)OC=C4)C(=O)C=C1O

Isomeric SMILES

CCC1=C/C(=C\2/NNC(=S)N2C3=CC4=C(C=C3)OC=C4)/C(=O)C=C1O

InChI

InChI=1S/C18H15N3O3S/c1-2-10-8-13(15(23)9-14(10)22)17-19-20-18(25)21(17)12-3-4-16-11(7-12)5-6-24-16/h3-9,19,22H,2H2,1H3,(H,20,25)/b17-13+