methyl (2S,3R)-2-[[(2S)-2-azanyl-3-(triphenylmethyl)sulfanyl-propanoyl]amino]-3-oxidanyl-butanoate

Systemtic Name: methyl (2S,3R)-2-[[(2S)-2-azanyl-3-(triphenylmethyl)sulfanyl-propanoyl]amino]-3-oxidanyl-butanoate Openeye Name: methyl (2S,3R)-2-[[(2S)-2-amino-3-tritylsulfanyl-propanoyl]amino]-3-hydroxy-butanoate CAS Name: (2S,3R)-2-[[(2S)-2-amino-1-oxo-3-[(triphenylmethyl)thio]propyl]amino]-3-hydroxybutanoic acid methyl ester IUPAC Name: methyl (2S,3R)-2-[[(2S)-2-amino-3-tritylsulfanylpropanoyl]amino]-3-hydroxybutanoate Traditional Name: (2S,3R)-2-[[(2S)-2-amino-3-(tritylthio)propanoyl]amino]-3-hydroxy-butyric acid methyl ester Formula: C27H30N2O4S MolecularWeight: 478.6031

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(C(=O)OC)NC(=O)C(CSC(C1=CC=CC=C1)(C2=CC=CC=C2)C3=CC=CC=C3)N)O

Isomeric SMILES

C[C@H]([C@@H](C(=O)OC)NC(=O)[C@@H](CSC(C1=CC=CC=C1)(C2=CC=CC=C2)C3=CC=CC=C3)N)O

InChI

InChI=1S/C27H30N2O4S/c1-19(30)24(26(32)33-2)29-25(31)23(28)18-34-27(20-12-6-3-7-13-20,21-14-8-4-9-15-21)22-16-10-5-11-17-22/h3-17,19,23-24,30H,18,28H2,1-2H3,(H,29,31)/t19-,23-,24+/m1/s1