tert-butyl N-[(2R)-1-(octadecylamino)-1-oxidanylidene-3-(pentyldisulfanyl)propan-2-yl]carbamate

Systemtic Name: tert-butyl N-[(2R)-1-(octadecylamino)-1-oxidanylidene-3-(pentyldisulfanyl)propan-2-yl]carbamate Openeye Name: tert-butyl N-[(1R)-2-(octadecylamino)-2-oxo-1-[(pentyldisulfanyl)methyl]ethyl]carbamate CAS Name: N-[(2R)-1-(octadecylamino)-1-oxo-3-(pentyldisulfanyl)propan-2-yl]carbamic acid tert-butyl ester IUPAC Name: tert-butyl N-[(2R)-1-(octadecylamino)-1-oxo-3-(pentyldisulfanyl)propan-2-yl]carbamate Traditional Name: N-[(1R)-1-[(amyldisulfanyl)methyl]-2-keto-2-(stearylamino)ethyl]carbamic acid tert-butyl ester Formula: C31H62N2O3S2 MolecularWeight: 574.96558

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCCCCCNC(=O)C(CSSCCCCC)NC(=O)OC(C)(C)C

Isomeric SMILES

CCCCCCCCCCCCCCCCCCNC(=O)[C@H](CSSCCCCC)NC(=O)OC(C)(C)C

InChI

InChI=1S/C31H62N2O3S2/c1-6-8-10-11-12-13-14-15-16-17-18-19-20-21-22-23-25-32-29(34)28(27-38-37-26-24-9-7-2)33-30(35)36-31(3,4)5/h28H,6-27H2,1-5H3,(H,32,34)(H,33,35)/t28-/m0/s1