(4Z)-4-[3-(1H-benzimidazol-2-yl)-1,2-dihydroindazol-6-ylidene]-3-methylsulfanyl-cyclohexa-2,5-dien-1-one

Systemtic Name: (4Z)-4-[3-(1H-benzimidazol-2-yl)-1,2-dihydroindazol-6-ylidene]-3-methylsulfanyl-cyclohexa-2,5-dien-1-one Openeye Name: (4Z)-4-[3-(1H-benzimidazol-2-yl)-1,2-dihydroindazol-6-ylidene]-3-methylsulfanyl-cyclohexa-2,5-dien-1-one CAS Name: (4Z)-4-[3-(1H-benzimidazol-2-yl)-1,2-dihydroindazol-6-ylidene]-3-(methylthio)-1-cyclohexa-2,5-dienone IUPAC Name: (4Z)-4-[3-(1H-benzimidazol-2-yl)-1,2-dihydroindazol-6-ylidene]-3-methylsulfanylcyclohexa-2,5-dien-1-one Traditional Name: (4Z)-4-[3-(1H-benzimidazol-2-yl)-1,2-dihydroindazol-6-ylidene]-3-(methylthio)cyclohexa-2,5-dien-1-one Formula: C21H16N4OS MolecularWeight: 372.44294

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Descriptors Computed from Structure

Canonical SMILES:

CSC1=CC(=O)C=CC1=C2C=CC3=C(NNC3=C2)C4=NC5=CC=CC=C5N4

Isomeric SMILES

CSC\1=CC(=O)C=C/C1=C/2\C=CC3=C(NNC3=C2)C4=NC5=CC=CC=C5N4

InChI

InChI=1S/C21H16N4OS/c1-27-19-11-13(26)7-9-14(19)12-6-8-15-18(10-12)24-25-20(15)21-22-16-4-2-3-5-17(16)23-21/h2-11,24-25H,1H3,(H,22,23)/b14-12-