3-[(phenylmethyl)carbamothioylamino]propanoic acid

Systemtic Name: 3-[(phenylmethyl)carbamothioylamino]propanoic acid Openeye Name: 3-(benzylcarbamothioylamino)propanoic acid CAS Name: 3-[[[(phenylmethyl)amino]-sulfanylidenemethyl]amino]propanoic acid IUPAC Name: 3-(benzylcarbamothioylamino)propanoic acid Traditional Name: 3-(benzylthiocarbamoylamino)propionic acid Formula: C11H14N2O2S MolecularWeight: 238.30606

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CNC(=S)NCCC(=O)O

Isomeric SMILES

C1=CC=C(C=C1)CNC(=S)NCCC(=O)O

InChI

InChI=1S/C11H14N2O2S/c14-10(15)6-7-12-11(16)13-8-9-4-2-1-3-5-9/h1-5H,6-8H2,(H,14,15)(H2,12,13,16)