tert-butyl N-[(2R)-1-azanyl-1-oxidanylidene-3-[2-oxidanylidene-2-[(phenylmethyl)amino]ethyl]sulfanyl-propan-2-yl]carbamate

Systemtic Name: tert-butyl N-[(2R)-1-azanyl-1-oxidanylidene-3-[2-oxidanylidene-2-[(phenylmethyl)amino]ethyl]sulfanyl-propan-2-yl]carbamate Openeye Name: tert-butyl N-[(1R)-2-amino-1-[[2-(benzylamino)-2-oxo-ethyl]sulfanylmethyl]-2-oxo-ethyl]carbamate CAS Name: N-[(2R)-1-amino-1-oxo-3-[[2-oxo-2-[(phenylmethyl)amino]ethyl]thio]propan-2-yl]carbamic acid tert-butyl ester IUPAC Name: tert-butyl N-[(2R)-1-amino-3-[2-(benzylamino)-2-oxoethyl]sulfanyl-1-oxopropan-2-yl]carbamate Traditional Name: N-[(1R)-2-amino-1-[[[2-(benzylamino)-2-keto-ethyl]thio]methyl]-2-keto-ethyl]carbamic acid tert-butyl ester Formula: C17H25N3O4S MolecularWeight: 367.4631

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)NC(CSCC(=O)NCC1=CC=CC=C1)C(=O)N

Isomeric SMILES

CC(C)(C)OC(=O)N[C@@H](CSCC(=O)NCC1=CC=CC=C1)C(=O)N

InChI

InChI=1S/C17H25N3O4S/c1-17(2,3)24-16(23)20-13(15(18)22)10-25-11-14(21)19-9-12-7-5-4-6-8-12/h4-8,13H,9-11H2,1-3H3,(H2,18,22)(H,19,21)(H,20,23)/t13-/m0/s1