tert-butyl N-[(2S)-1-azanyl-4-methylsulfanyl-1-oxidanylidene-butan-2-yl]-N-[(2S)-2-azanyl-3-phenyl-propanoyl]carbamate

Systemtic Name: tert-butyl N-[(2S)-1-azanyl-4-methylsulfanyl-1-oxidanylidene-butan-2-yl]-N-[(2S)-2-azanyl-3-phenyl-propanoyl]carbamate Openeye Name: tert-butyl N-[(2S)-2-amino-3-phenyl-propanoyl]-N-[(1S)-1-carbamoyl-3-methylsulfanyl-propyl]carbamate CAS Name: N-[(2S)-1-amino-4-(methylthio)-1-oxobutan-2-yl]-N-[(2S)-2-amino-1-oxo-3-phenylpropyl]carbamic acid tert-butyl ester IUPAC Name: tert-butyl N-[(2S)-1-amino-4-methylsulfanyl-1-oxobutan-2-yl]-N-[(2S)-2-amino-3-phenylpropanoyl]carbamate Traditional Name: N-[(2S)-2-amino-3-phenyl-propanoyl]-N-[(1S)-1-carbamoyl-3-(methylthio)propyl]carbamic acid tert-butyl ester Formula: C19H29N3O4S MolecularWeight: 395.51626

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)N(C(CCSC)C(=O)N)C(=O)C(CC1=CC=CC=C1)N

Isomeric SMILES

CC(C)(C)OC(=O)N([C@@H](CCSC)C(=O)N)C(=O)[C@H](CC1=CC=CC=C1)N

InChI

InChI=1S/C19H29N3O4S/c1-19(2,3)26-18(25)22(15(16(21)23)10-11-27-4)17(24)14(20)12-13-8-6-5-7-9-13/h5-9,14-15H,10-12,20H2,1-4H3,(H2,21,23)/t14-,15-/m0/s1