3-(4-sulfanylidene-1,3,5-triazinan-1-yl)propanoic acid

Systemtic Name: 3-(4-sulfanylidene-1,3,5-triazinan-1-yl)propanoic acid Openeye Name: 3-(4-thioxo-1,3,5-triazinan-1-yl)propanoic acid CAS Name: 3-(4-sulfanylidene-1,3,5-triazinan-1-yl)propanoic acid IUPAC Name: 3-(4-sulfanylidene-1,3,5-triazinan-1-yl)propanoic acid Traditional Name: 3-(4-thioxo-1,3,5-triazinan-1-yl)propionic acid Formula: C6H11N3O2S MolecularWeight: 189.23544

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Descriptors Computed from Structure

Canonical SMILES:

C1NC(=S)NCN1CCC(=O)O

Isomeric SMILES

C1NC(=S)NCN1CCC(=O)O

InChI

InChI=1S/C6H11N3O2S/c10-5(11)1-2-9-3-7-6(12)8-4-9/h1-4H2,(H,10,11)(H2,7,8,12)