(6Z)-4-cyclopropyl-6-[4-(7-fluoranylnaphthalen-1-yl)-5-sulfanyl-1,2-dihydropyrazol-3-ylidene]-3-oxidanyl-cyclohexa-2,4-dien-1-one

Systemtic Name: (6Z)-4-cyclopropyl-6-[4-(7-fluoranylnaphthalen-1-yl)-5-sulfanyl-1,2-dihydropyrazol-3-ylidene]-3-oxidanyl-cyclohexa-2,4-dien-1-one Openeye Name: (6Z)-4-cyclopropyl-6-[4-(7-fluoro-1-naphthyl)-5-sulfanyl-1,2-dihydropyrazol-3-ylidene]-3-hydroxy-cyclohexa-2,4-dien-1-one CAS Name: (6Z)-4-cyclopropyl-6-[4-(7-fluoro-1-naphthalenyl)-5-mercapto-1,2-dihydropyrazol-3-ylidene]-3-hydroxy-1-cyclohexa-2,4-dienone IUPAC Name: (6Z)-4-cyclopropyl-6-[4-(7-fluoronaphthalen-1-yl)-5-sulfanyl-1,2-dihydropyrazol-3-ylidene]-3-hydroxycyclohexa-2,4-dien-1-one Traditional Name: (6Z)-4-cyclopropyl-6-[4-(7-fluoro-1-naphthyl)-5-mercapto-3-pyrazolin-3-ylidene]-3-hydroxy-cyclohexa-2,4-dien-1-one Formula: C22H17FN2O2S MolecularWeight: 392.445983

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Descriptors Computed from Structure

Canonical SMILES:

C1CC1C2=CC(=C3C(=C(NN3)S)C4=CC=CC5=C4C=C(C=C5)F)C(=O)C=C2O

Isomeric SMILES

C1CC1C2=C/C(=C/3\C(=C(NN3)S)C4=CC=CC5=C4C=C(C=C5)F)/C(=O)C=C2O

InChI

InChI=1S/C22H17FN2O2S/c23-13-7-6-11-2-1-3-14(15(11)8-13)20-21(24-25-22(20)28)17-9-16(12-4-5-12)18(26)10-19(17)27/h1-3,6-10,12,24-26,28H,4-5H2/b21-17-