tert-butyl N-[1-(1H-pyrazol-5-yl)-3-sulfanyl-propan-2-yl]carbamate

Systemtic Name: tert-butyl N-[1-(1H-pyrazol-5-yl)-3-sulfanyl-propan-2-yl]carbamate Openeye Name: tert-butyl N-[1-(1H-pyrazol-5-ylmethyl)-2-sulfanyl-ethyl]carbamate CAS Name: N-[1-mercapto-3-(1H-pyrazol-5-yl)propan-2-yl]carbamic acid tert-butyl ester IUPAC Name: tert-butyl N-[1-(1H-pyrazol-5-yl)-3-sulfanylpropan-2-yl]carbamate Traditional Name: N-[1-(mercaptomethyl)-2-(1H-pyrazol-5-yl)ethyl]carbamic acid tert-butyl ester Formula: C11H19N3O2S MolecularWeight: 257.35246

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)NC(CC1=CC=NN1)CS

Isomeric SMILES

CC(C)(C)OC(=O)NC(CC1=CC=NN1)CS

InChI

InChI=1S/C11H19N3O2S/c1-11(2,3)16-10(15)13-9(7-17)6-8-4-5-12-14-8/h4-5,9,17H,6-7H2,1-3H3,(H,12,14)(H,13,15)