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

Systemtic Name: (4Z)-4-[4-(2-methylquinolin-4-yl)-5-sulfanylidene-1,2,4-triazolidin-3-ylidene]-3-oxidanyl-cyclohexa-2,5-dien-1-one Openeye Name: (4Z)-3-hydroxy-4-[4-(2-methyl-4-quinolyl)-5-thioxo-1,2,4-triazolidin-3-ylidene]cyclohexa-2,5-dien-1-one CAS Name: (4Z)-3-hydroxy-4-[4-(2-methyl-4-quinolinyl)-5-sulfanylidene-1,2,4-triazolidin-3-ylidene]-1-cyclohexa-2,5-dienone IUPAC Name: (4Z)-3-hydroxy-4-[4-(2-methylquinolin-4-yl)-5-sulfanylidene-1,2,4-triazolidin-3-ylidene]cyclohexa-2,5-dien-1-one Traditional Name: (4Z)-3-hydroxy-4-[4-(2-methyl-4-quinolyl)-5-thioxo-1,2,4-triazolidin-3-ylidene]cyclohexa-2,5-dien-1-one Formula: C18H14N4O2S MolecularWeight: 350.39436

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC2=CC=CC=C2C(=C1)N3C(=C4C=CC(=O)C=C4O)NNC3=S

Isomeric SMILES

CC1=NC2=CC=CC=C2C(=C1)N3/C(=C/4\C=CC(=O)C=C4O)/NNC3=S

InChI

InChI=1S/C18H14N4O2S/c1-10-8-15(12-4-2-3-5-14(12)19-10)22-17(20-21-18(22)25)13-7-6-11(23)9-16(13)24/h2-9,20,24H,1H3,(H,21,25)/b17-13+