tert-butyl N-(3-pyridin-4-ylsulfanylpropyl)carbamate

Systemtic Name: tert-butyl N-(3-pyridin-4-ylsulfanylpropyl)carbamate Openeye Name: tert-butyl N-[3-(4-pyridylsulfanyl)propyl]carbamate CAS Name: N-[3-(pyridin-4-ylthio)propyl]carbamic acid tert-butyl ester IUPAC Name: tert-butyl N-(3-pyridin-4-ylsulfanylpropyl)carbamate Traditional Name: N-[3-(4-pyridylthio)propyl]carbamic acid tert-butyl ester Formula: C13H20N2O2S MolecularWeight: 268.3751

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)NCCCSC1=CC=NC=C1

Isomeric SMILES

CC(C)(C)OC(=O)NCCCSC1=CC=NC=C1

InChI

InChI=1S/C13H20N2O2S/c1-13(2,3)17-12(16)15-7-4-10-18-11-5-8-14-9-6-11/h5-6,8-9H,4,7,10H2,1-3H3,(H,15,16)