tert-butyl 5-methylsulfanylindole-1-carboxylate

Systemtic Name: tert-butyl 5-methylsulfanylindole-1-carboxylate Openeye Name: tert-butyl 5-methylsulfanylindole-1-carboxylate CAS Name: 5-(methylthio)-1-indolecarboxylic acid tert-butyl ester IUPAC Name: tert-butyl 5-methylsulfanylindole-1-carboxylate Traditional Name: 5-(methylthio)indole-1-carboxylic acid tert-butyl ester Formula: C14H17NO2S MolecularWeight: 263.35528

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)N1C=CC2=C1C=CC(=C2)SC

Isomeric SMILES

CC(C)(C)OC(=O)N1C=CC2=C1C=CC(=C2)SC

InChI

InChI=1S/C14H17NO2S/c1-14(2,3)17-13(16)15-8-7-10-9-11(18-4)5-6-12(10)15/h5-9H,1-4H3