(2R)-2-azaniumyl-3-[(phenylmethyl)carbamothioylsulfanyl]propanoate

Systemtic Name: (2R)-2-azaniumyl-3-[(phenylmethyl)carbamothioylsulfanyl]propanoate Openeye Name: (2R)-2-azaniumyl-3-(benzylcarbamothioylsulfanyl)propanoate CAS Name: (2R)-2-ammonio-3-[[[(phenylmethyl)amino]-sulfanylidenemethyl]thio]propanoate IUPAC Name: (2R)-2-azaniumyl-3-(benzylcarbamothioylsulfanyl)propanoate Traditional Name: (2R)-2-ammonio-3-(benzylthiocarbamoylthio)propionate 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-])[NH3+]

Isomeric SMILES

C1=CC=C(C=C1)CNC(=S)SC[C@@H](C(=O)[O-])[NH3+]

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-/m0/s1