1-(1,3-benzothiazol-2-yl)-3-(2-fluorophenyl)-6,6-dimethyl-4-oxidanylidene-5,7-dihydroindazole-5-carbonitrile

Systemtic Name: 1-(1,3-benzothiazol-2-yl)-3-(2-fluorophenyl)-6,6-dimethyl-4-oxidanylidene-5,7-dihydroindazole-5-carbonitrile Openeye Name: 1-(1,3-benzothiazol-2-yl)-3-(2-fluorophenyl)-6,6-dimethyl-4-oxo-5,7-dihydroindazole-5-carbonitrile CAS Name: 1-(1,3-benzothiazol-2-yl)-3-(2-fluorophenyl)-6,6-dimethyl-4-oxo-5,7-dihydroindazole-5-carbonitrile IUPAC Name: 1-(1,3-benzothiazol-2-yl)-3-(2-fluorophenyl)-6,6-dimethyl-4-oxo-5,7-dihydroindazole-5-carbonitrile Traditional Name: 1-(1,3-benzothiazol-2-yl)-3-(2-fluorophenyl)-4-keto-6,6-dimethyl-5,7-dihydroindazole-5-carbonitrile Formula: C23H17FN4OS MolecularWeight: 416.470683

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Descriptors Computed from Structure

Canonical SMILES:

CC1(CC2=C(C(=O)C1C#N)C(=NN2C3=NC4=CC=CC=C4S3)C5=CC=CC=C5F)C

Isomeric SMILES

CC1(CC2=C(C(=O)C1C#N)C(=NN2C3=NC4=CC=CC=C4S3)C5=CC=CC=C5F)C

InChI

InChI=1S/C23H17FN4OS/c1-23(2)11-17-19(21(29)14(23)12-25)20(13-7-3-4-8-15(13)24)27-28(17)22-26-16-9-5-6-10-18(16)30-22/h3-10,14H,11H2,1-2H3