tert-butyl 7-[(2S)-2-methyl-3-oxidanyl-propyl]sulfanylindole-1-carboxylate

Systemtic Name: tert-butyl 7-[(2S)-2-methyl-3-oxidanyl-propyl]sulfanylindole-1-carboxylate Openeye Name: tert-butyl 7-[(2S)-3-hydroxy-2-methyl-propyl]sulfanylindole-1-carboxylate CAS Name: 7-[[(2S)-3-hydroxy-2-methylpropyl]thio]-1-indolecarboxylic acid tert-butyl ester IUPAC Name: tert-butyl 7-[(2S)-3-hydroxy-2-methylpropyl]sulfanylindole-1-carboxylate Traditional Name: 7-[[(2S)-3-hydroxy-2-methyl-propyl]thio]indole-1-carboxylic acid tert-butyl ester Formula: C17H23NO3S MolecularWeight: 321.43442

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Descriptors Computed from Structure

Canonical SMILES:

CC(CO)CSC1=CC=CC2=C1N(C=C2)C(=O)OC(C)(C)C

Isomeric SMILES

C[C@@H](CO)CSC1=CC=CC2=C1N(C=C2)C(=O)OC(C)(C)C

InChI

InChI=1S/C17H23NO3S/c1-12(10-19)11-22-14-7-5-6-13-8-9-18(15(13)14)16(20)21-17(2,3)4/h5-9,12,19H,10-11H2,1-4H3/t12-/m0/s1