tert-butyl N-[1-(1H-indol-3-yl)-3-sulfanyl-propan-2-yl]carbamate

Systemtic Name: tert-butyl N-[1-(1H-indol-3-yl)-3-sulfanyl-propan-2-yl]carbamate Openeye Name: tert-butyl N-[1-(1H-indol-3-ylmethyl)-2-sulfanyl-ethyl]carbamate CAS Name: N-[1-(1H-indol-3-yl)-3-mercaptopropan-2-yl]carbamic acid tert-butyl ester IUPAC Name: tert-butyl N-[1-(1H-indol-3-yl)-3-sulfanylpropan-2-yl]carbamate Traditional Name: N-[1-(1H-indol-3-ylmethyl)-2-mercapto-ethyl]carbamic acid tert-butyl ester Formula: C16H22N2O2S MolecularWeight: 306.42308

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)NC(CC1=CNC2=CC=CC=C21)CS

Isomeric SMILES

CC(C)(C)OC(=O)NC(CC1=CNC2=CC=CC=C21)CS

InChI

InChI=1S/C16H22N2O2S/c1-16(2,3)20-15(19)18-12(10-21)8-11-9-17-14-7-5-4-6-13(11)14/h4-7,9,12,17,21H,8,10H2,1-3H3,(H,18,19)