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

Systemtic Name: 1-(1,3-benzothiazol-2-yl)-6,6-dimethyl-4-oxidanylidene-3-(2-phenylcyclopropyl)-5,7-dihydroindazole-7-carbonitrile Openeye Name: 1-(1,3-benzothiazol-2-yl)-6,6-dimethyl-4-oxo-3-(2-phenylcyclopropyl)-5,7-dihydroindazole-7-carbonitrile CAS Name: 1-(1,3-benzothiazol-2-yl)-6,6-dimethyl-4-oxo-3-(2-phenylcyclopropyl)-5,7-dihydroindazole-7-carbonitrile IUPAC Name: 1-(1,3-benzothiazol-2-yl)-6,6-dimethyl-4-oxo-3-(2-phenylcyclopropyl)-5,7-dihydroindazole-7-carbonitrile Traditional Name: 1-(1,3-benzothiazol-2-yl)-4-keto-6,6-dimethyl-3-(2-phenylcyclopropyl)-5,7-dihydroindazole-7-carbonitrile Formula: C26H22N4OS MolecularWeight: 438.54408

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Descriptors Computed from Structure

Canonical SMILES:

CC1(CC(=O)C2=C(C1C#N)N(N=C2C3CC3C4=CC=CC=C4)C5=NC6=CC=CC=C6S5)C

Isomeric SMILES

CC1(CC(=O)C2=C(C1C#N)N(N=C2C3CC3C4=CC=CC=C4)C5=NC6=CC=CC=C6S5)C

InChI

InChI=1S/C26H22N4OS/c1-26(2)13-20(31)22-23(17-12-16(17)15-8-4-3-5-9-15)29-30(24(22)18(26)14-27)25-28-19-10-6-7-11-21(19)32-25/h3-11,16-18H,12-13H2,1-2H3