disodium (2S)-3-phenyl-2-(sulfanidylcarbothioylamino)propanoate

Systemtic Name: disodium (2S)-3-phenyl-2-(sulfanidylcarbothioylamino)propanoate Openeye Name: disodium (2S)-3-phenyl-2-(sulfidocarbothioylamino)propanoate CAS Name: disodium (2S)-3-phenyl-2-[[sulfanylidene(sulfido)methyl]amino]propanoate IUPAC Name: disodium (2S)-3-phenyl-2-(sulfidocarbothioylamino)propanoate Traditional Name: disodium (2S)-3-phenyl-2-(sulfidocarbothioylamino)propionate Formula: C10H9NNa2O2S2 MolecularWeight: 285.2935

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CC(C(=O)[O-])NC(=S)[S-].[Na+].[Na+]

Isomeric SMILES

C1=CC=C(C=C1)C[C@@H](C(=O)[O-])NC(=S)[S-].[Na+].[Na+]

InChI

InChI=1S/C10H11NO2S2.2Na/c12-9(13)8(11-10(14)15)6-7-4-2-1-3-5-7;;/h1-5,8H,6H2,(H,12,13)(H2,11,14,15);;/q;2*+1/p-2/t8-;;/m0../s1