tert-butyl N-[(2S)-1-isothiocyanato-3-phenyl-propan-2-yl]carbamate

Systemtic Name: tert-butyl N-[(2S)-1-isothiocyanato-3-phenyl-propan-2-yl]carbamate Openeye Name: tert-butyl N-[(1S)-1-benzyl-2-isothiocyanato-ethyl]carbamate CAS Name: N-[(2S)-1-isothiocyanato-3-phenylpropan-2-yl]carbamic acid tert-butyl ester IUPAC Name: tert-butyl N-[(2S)-1-isothiocyanato-3-phenylpropan-2-yl]carbamate Traditional Name: N-[(1S)-1-benzyl-2-isothiocyanato-ethyl]carbamic acid tert-butyl ester Formula: C15H20N2O2S MolecularWeight: 292.3965

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)NC(CC1=CC=CC=C1)CN=C=S

Isomeric SMILES

CC(C)(C)OC(=O)N[C@@H](CC1=CC=CC=C1)CN=C=S

InChI

InChI=1S/C15H20N2O2S/c1-15(2,3)19-14(18)17-13(10-16-11-20)9-12-7-5-4-6-8-12/h4-8,13H,9-10H2,1-3H3,(H,17,18)/t13-/m0/s1