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

Systemtic Name: 4-[3-(1H-benzimidazol-2-yl)-1,2-dihydroindazol-6-ylidene]-3,5-dimethyl-cyclohexa-2,5-dien-1-one Openeye Name: 4-[3-(1H-benzimidazol-2-yl)-1,2-dihydroindazol-6-ylidene]-3,5-dimethyl-cyclohexa-2,5-dien-1-one CAS Name: 4-[3-(1H-benzimidazol-2-yl)-1,2-dihydroindazol-6-ylidene]-3,5-dimethyl-1-cyclohexa-2,5-dienone IUPAC Name: 4-[3-(1H-benzimidazol-2-yl)-1,2-dihydroindazol-6-ylidene]-3,5-dimethylcyclohexa-2,5-dien-1-one Traditional Name: 4-[3-(1H-benzimidazol-2-yl)-1,2-dihydroindazol-6-ylidene]-3,5-dimethyl-cyclohexa-2,5-dien-1-one Formula: C22H18N4O MolecularWeight: 354.40452

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=O)C=C(C1=C2C=CC3=C(NNC3=C2)C4=NC5=CC=CC=C5N4)C

Isomeric SMILES

CC1=CC(=O)C=C(C1=C2C=CC3=C(NNC3=C2)C4=NC5=CC=CC=C5N4)C

InChI

InChI=1S/C22H18N4O/c1-12-9-15(27)10-13(2)20(12)14-7-8-16-19(11-14)25-26-21(16)22-23-17-5-3-4-6-18(17)24-22/h3-11,25-26H,1-2H3,(H,23,24)