2-[(1-tert-butyl-1,2,3,4-tetrazol-5-yl)sulfanyl]-1-(2,3-dihydroindol-1-yl)propan-1-one

Systemtic Name: 2-[(1-tert-butyl-1,2,3,4-tetrazol-5-yl)sulfanyl]-1-(2,3-dihydroindol-1-yl)propan-1-one Openeye Name: 2-(1-tert-butyltetrazol-5-yl)sulfanyl-1-indolin-1-yl-propan-1-one CAS Name: 2-[(1-tert-butyl-5-tetrazolyl)thio]-1-(2,3-dihydroindol-1-yl)-1-propanone IUPAC Name: 2-(1-tert-butyltetrazol-5-yl)sulfanyl-1-(2,3-dihydroindol-1-yl)propan-1-one Traditional Name: 2-[(1-tert-butyltetrazol-5-yl)thio]-1-indolin-1-yl-propan-1-one Formula: C16H21N5OS MolecularWeight: 331.43584

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)N1CCC2=CC=CC=C21)SC3=NN=NN3C(C)(C)C

Isomeric SMILES

CC(C(=O)N1CCC2=CC=CC=C21)SC3=NN=NN3C(C)(C)C

InChI

InChI=1S/C16H21N5OS/c1-11(23-15-17-18-19-21(15)16(2,3)4)14(22)20-10-9-12-7-5-6-8-13(12)20/h5-8,11H,9-10H2,1-4H3