tert-butyl (2R)-2-[[(2S)-2-azanylpropanoyl]amino]-3-(phenylmethylsulfanyl)propanoate

Systemtic Name: tert-butyl (2R)-2-[[(2S)-2-azanylpropanoyl]amino]-3-(phenylmethylsulfanyl)propanoate Openeye Name: tert-butyl (2R)-2-[[(2S)-2-aminopropanoyl]amino]-3-benzylsulfanyl-propanoate CAS Name: (2R)-2-[[(2S)-2-amino-1-oxopropyl]amino]-3-(phenylmethylthio)propanoic acid tert-butyl ester IUPAC Name: tert-butyl (2R)-2-[[(2S)-2-aminopropanoyl]amino]-3-benzylsulfanylpropanoate Traditional Name: (2R)-2-[[(2S)-2-aminopropanoyl]amino]-3-(benzylthio)propionic acid tert-butyl ester Formula: C17H26N2O3S MolecularWeight: 338.46494

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)NC(CSCC1=CC=CC=C1)C(=O)OC(C)(C)C)N

Isomeric SMILES

C[C@@H](C(=O)N[C@@H](CSCC1=CC=CC=C1)C(=O)OC(C)(C)C)N

InChI

InChI=1S/C17H26N2O3S/c1-12(18)15(20)19-14(16(21)22-17(2,3)4)11-23-10-13-8-6-5-7-9-13/h5-9,12,14H,10-11,18H2,1-4H3,(H,19,20)/t12-,14-/m0/s1