(4Z)-4-[4-(1H-indol-4-yl)-5-sulfanyl-1,2-dihydropyrazol-3-ylidene]-3-oxidanyl-cyclohexa-2,5-dien-1-one

Systemtic Name: (4Z)-4-[4-(1H-indol-4-yl)-5-sulfanyl-1,2-dihydropyrazol-3-ylidene]-3-oxidanyl-cyclohexa-2,5-dien-1-one Openeye Name: (4Z)-3-hydroxy-4-[4-(1H-indol-4-yl)-5-sulfanyl-1,2-dihydropyrazol-3-ylidene]cyclohexa-2,5-dien-1-one CAS Name: (4Z)-3-hydroxy-4-[4-(1H-indol-4-yl)-5-mercapto-1,2-dihydropyrazol-3-ylidene]-1-cyclohexa-2,5-dienone IUPAC Name: (4Z)-3-hydroxy-4-[4-(1H-indol-4-yl)-5-sulfanyl-1,2-dihydropyrazol-3-ylidene]cyclohexa-2,5-dien-1-one Traditional Name: (4Z)-3-hydroxy-4-[4-(1H-indol-4-yl)-5-mercapto-3-pyrazolin-3-ylidene]cyclohexa-2,5-dien-1-one Formula: C17H13N3O2S MolecularWeight: 323.36902

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=C2C=CNC2=C1)C3=C(NNC3=C4C=CC(=O)C=C4O)S

Isomeric SMILES

C1=CC(=C2C=CNC2=C1)C\3=C(NN/C3=C\4/C=CC(=O)C=C4O)S

InChI

InChI=1S/C17H13N3O2S/c21-9-4-5-12(14(22)8-9)16-15(17(23)20-19-16)11-2-1-3-13-10(11)6-7-18-13/h1-8,18-20,22-23H/b16-12-