tert-butyl N-[(2S)-1-(tert-butylamino)-1-oxidanylidene-7-sulfanyl-heptan-2-yl]carbamate

Systemtic Name: tert-butyl N-[(2S)-1-(tert-butylamino)-1-oxidanylidene-7-sulfanyl-heptan-2-yl]carbamate Openeye Name: tert-butyl N-[(1S)-1-(tert-butylcarbamoyl)-6-sulfanyl-hexyl]carbamate CAS Name: N-[(2S)-1-(tert-butylamino)-7-mercapto-1-oxoheptan-2-yl]carbamic acid tert-butyl ester IUPAC Name: tert-butyl N-[(2S)-1-(tert-butylamino)-1-oxo-7-sulfanylheptan-2-yl]carbamate Traditional Name: N-[(1S)-1-(tert-butylcarbamoyl)-6-mercapto-hexyl]carbamic acid tert-butyl ester Formula: C16H32N2O3S MolecularWeight: 332.50188

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)NC(=O)C(CCCCCS)NC(=O)OC(C)(C)C

Isomeric SMILES

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

InChI

InChI=1S/C16H32N2O3S/c1-15(2,3)18-13(19)12(10-8-7-9-11-22)17-14(20)21-16(4,5)6/h12,22H,7-11H2,1-6H3,(H,17,20)(H,18,19)/t12-/m0/s1