2-(5-phenethyl-2-sulfanylidene-1,3,5-thiadiazinan-3-yl)ethanoic acid

Systemtic Name: 2-(5-phenethyl-2-sulfanylidene-1,3,5-thiadiazinan-3-yl)ethanoic acid Openeye Name: 2-(5-phenethyl-2-thioxo-1,3,5-thiadiazinan-3-yl)acetic acid CAS Name: 2-(5-phenethyl-2-sulfanylidene-1,3,5-thiadiazinan-3-yl)acetic acid IUPAC Name: 2-(5-phenethyl-2-sulfanylidene-1,3,5-thiadiazinan-3-yl)acetic acid Traditional Name: 2-(5-phenethyl-2-thioxo-1,3,5-thiadiazinan-3-yl)acetic acid Formula: C13H16N2O2S2 MolecularWeight: 296.40834

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Descriptors Computed from Structure

Canonical SMILES:

C1N(CSC(=S)N1CC(=O)O)CCC2=CC=CC=C2

Isomeric SMILES

C1N(CSC(=S)N1CC(=O)O)CCC2=CC=CC=C2

InChI

InChI=1S/C13H16N2O2S2/c16-12(17)8-15-9-14(10-19-13(15)18)7-6-11-4-2-1-3-5-11/h1-5H,6-10H2,(H,16,17)