tert-butyl N-[(2S)-1-[[(2S)-1-azanyl-1-oxidanylidene-propan-2-yl]amino]-1-oxidanylidene-4-sulfanyl-butan-2-yl]carbamate

Systemtic Name: tert-butyl N-[(2S)-1-[[(2S)-1-azanyl-1-oxidanylidene-propan-2-yl]amino]-1-oxidanylidene-4-sulfanyl-butan-2-yl]carbamate Openeye Name: tert-butyl N-[(1S)-1-[[(1S)-2-amino-1-methyl-2-oxo-ethyl]carbamoyl]-3-sulfanyl-propyl]carbamate CAS Name: N-[(2S)-1-[[(2S)-1-amino-1-oxopropan-2-yl]amino]-4-mercapto-1-oxobutan-2-yl]carbamic acid tert-butyl ester IUPAC Name: tert-butyl N-[(2S)-1-[[(2S)-1-amino-1-oxopropan-2-yl]amino]-1-oxo-4-sulfanylbutan-2-yl]carbamate Traditional Name: N-[(1S)-1-[[(1S)-2-amino-2-keto-1-methyl-ethyl]carbamoyl]-3-mercapto-propyl]carbamic acid tert-butyl ester Formula: C12H23N3O4S MolecularWeight: 305.39372

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)N)NC(=O)C(CCS)NC(=O)OC(C)(C)C

Isomeric SMILES

C[C@@H](C(=O)N)NC(=O)[C@H](CCS)NC(=O)OC(C)(C)C

InChI

InChI=1S/C12H23N3O4S/c1-7(9(13)16)14-10(17)8(5-6-20)15-11(18)19-12(2,3)4/h7-8,20H,5-6H2,1-4H3,(H2,13,16)(H,14,17)(H,15,18)/t7-,8-/m0/s1