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

Systemtic Name: tert-butyl N-[(2R)-1-azanyl-1-oxidanylidene-3-(2-oxidanylidene-2-phenylazanyl-ethyl)sulfanyl-propan-2-yl]carbamate Openeye Name: tert-butyl N-[(1R)-2-amino-1-[(2-anilino-2-oxo-ethyl)sulfanylmethyl]-2-oxo-ethyl]carbamate CAS Name: N-[(2R)-1-amino-3-[(2-anilino-2-oxoethyl)thio]-1-oxopropan-2-yl]carbamic acid tert-butyl ester IUPAC Name: tert-butyl N-[(2R)-1-amino-3-(2-anilino-2-oxoethyl)sulfanyl-1-oxopropan-2-yl]carbamate Traditional Name: N-[(1R)-2-amino-1-[[(2-anilino-2-keto-ethyl)thio]methyl]-2-keto-ethyl]carbamic acid tert-butyl ester Formula: C16H23N3O4S MolecularWeight: 353.43652

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)NC(CSCC(=O)NC1=CC=CC=C1)C(=O)N

Isomeric SMILES

CC(C)(C)OC(=O)N[C@@H](CSCC(=O)NC1=CC=CC=C1)C(=O)N

InChI

InChI=1S/C16H23N3O4S/c1-16(2,3)23-15(22)19-12(14(17)21)9-24-10-13(20)18-11-7-5-4-6-8-11/h4-8,12H,9-10H2,1-3H3,(H2,17,21)(H,18,20)(H,19,22)/t12-/m0/s1