tert-butyl N-[(2S)-1-isothiocyanato-3-methyl-butan-2-yl]carbamate

Systemtic Name: tert-butyl N-[(2S)-1-isothiocyanato-3-methyl-butan-2-yl]carbamate Openeye Name: tert-butyl N-[(1S)-1-(isothiocyanatomethyl)-2-methyl-propyl]carbamate CAS Name: N-[(2S)-1-isothiocyanato-3-methylbutan-2-yl]carbamic acid tert-butyl ester IUPAC Name: tert-butyl N-[(2S)-1-isothiocyanato-3-methylbutan-2-yl]carbamate Traditional Name: N-[(1S)-1-(isothiocyanatomethyl)-2-methyl-propyl]carbamic acid tert-butyl ester Formula: C11H20N2O2S MolecularWeight: 244.3537

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

CC(C)[C@@H](CN=C=S)NC(=O)OC(C)(C)C

InChI

InChI=1S/C11H20N2O2S/c1-8(2)9(6-12-7-16)13-10(14)15-11(3,4)5/h8-9H,6H2,1-5H3,(H,13,14)/t9-/m1/s1