[6-tert-butyl-1-(4-cyanophenyl)sulfonyl-2,3-dihydroindol-5-yl] thiocyanate

Systemtic Name: [6-tert-butyl-1-(4-cyanophenyl)sulfonyl-2,3-dihydroindol-5-yl] thiocyanate Openeye Name: [6-tert-butyl-1-(4-cyanophenyl)sulfonyl-indolin-5-yl] thiocyanate CAS Name: thiocyanic acid [6-tert-butyl-1-(4-cyanophenyl)sulfonyl-2,3-dihydroindol-5-yl] ester IUPAC Name: [6-tert-butyl-1-(4-cyanophenyl)sulfonyl-2,3-dihydroindol-5-yl] thiocyanate Traditional Name: thiocyanic acid [6-tert-butyl-1-(4-cyanophenyl)sulfonyl-indolin-5-yl] ester Formula: C20H19N3O2S2 MolecularWeight: 397.51376

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=C(C=C2CCN(C2=C1)S(=O)(=O)C3=CC=C(C=C3)C#N)SC#N

Isomeric SMILES

CC(C)(C)C1=C(C=C2CCN(C2=C1)S(=O)(=O)C3=CC=C(C=C3)C#N)SC#N

InChI

InChI=1S/C20H19N3O2S2/c1-20(2,3)17-11-18-15(10-19(17)26-13-22)8-9-23(18)27(24,25)16-6-4-14(12-21)5-7-16/h4-7,10-11H,8-9H2,1-3H3