Molecule ID: 6604703

IUPAC Name: (Z)-3-carbamimidoylsulfanylprop-2-enoic acid

Description: The molecule is an imidothiocarbamic ester that is (2Z)-prop-2-enoic acid with a carbamimidoylsulfanyl group at position 3. It has a role as a metabolite. It is an imidothiocarbamic ester and a monocarboxylic acid.

SMILES: N=C(N)S/C=C\C(=O)O

SELFIES: [N][=C][Branch1][C][N][S][/C][=C][\C][=Branch1][C][=O][O]

InChI: InChI=1S/C4H6N2O2S/c5-4(6)9-2-1-3(7)8/h1-2H,(H3,5,6)(H,7,8)/b2-1-

Molecular Properties:
- Polar Surface Area: 113.0 Ų
- LogP: -0.2