(2S)-2-azanyl-3-[(phenylmethyl)carbamothioylsulfanyl]propanoic acid

Systemtic Name: (2S)-2-azanyl-3-[(phenylmethyl)carbamothioylsulfanyl]propanoic acid Openeye Name: (2S)-2-amino-3-(benzylcarbamothioylsulfanyl)propanoic acid CAS Name: (2S)-2-amino-3-[[[(phenylmethyl)amino]-sulfanylidenemethyl]thio]propanoic acid IUPAC Name: (2S)-2-amino-3-(benzylcarbamothioylsulfanyl)propanoic acid Traditional Name: (2S)-2-amino-3-(benzylthiocarbamoylthio)propionic acid Formula: C11H14N2O2S2 MolecularWeight: 270.37106

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CNC(=S)SCC(C(=O)O)N

Isomeric SMILES

C1=CC=C(C=C1)CNC(=S)SC[C@H](C(=O)O)N

InChI

InChI=1S/C11H14N2O2S2/c12-9(10(14)15)7-17-11(16)13-6-8-4-2-1-3-5-8/h1-5,9H,6-7,12H2,(H,13,16)(H,14,15)/t9-/m1/s1