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

Systemtic Name: 1-(1,3-benzothiazol-2-yl)-6,6-dimethyl-4-oxidanylidene-3-(phenoxymethyl)-5,7-dihydroindazole-7-carbonitrile Openeye Name: 1-(1,3-benzothiazol-2-yl)-6,6-dimethyl-4-oxo-3-(phenoxymethyl)-5,7-dihydroindazole-7-carbonitrile CAS Name: 1-(1,3-benzothiazol-2-yl)-6,6-dimethyl-4-oxo-3-(phenoxymethyl)-5,7-dihydroindazole-7-carbonitrile IUPAC Name: 1-(1,3-benzothiazol-2-yl)-6,6-dimethyl-4-oxo-3-(phenoxymethyl)-5,7-dihydroindazole-7-carbonitrile Traditional Name: 1-(1,3-benzothiazol-2-yl)-4-keto-6,6-dimethyl-3-(phenoxymethyl)-5,7-dihydroindazole-7-carbonitrile Formula: C24H20N4O2S MolecularWeight: 428.5062

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Descriptors Computed from Structure

Canonical SMILES:

CC1(CC(=O)C2=C(C1C#N)N(N=C2COC3=CC=CC=C3)C4=NC5=CC=CC=C5S4)C

Isomeric SMILES

CC1(CC(=O)C2=C(C1C#N)N(N=C2COC3=CC=CC=C3)C4=NC5=CC=CC=C5S4)C

InChI

InChI=1S/C24H20N4O2S/c1-24(2)12-19(29)21-18(14-30-15-8-4-3-5-9-15)27-28(22(21)16(24)13-25)23-26-17-10-6-7-11-20(17)31-23/h3-11,16H,12,14H2,1-2H3