2-(5-butyl-6-sulfanylidene-1,3,5-thiadiazinan-3-yl)ethanoic acid

Systemtic Name: 2-(5-butyl-6-sulfanylidene-1,3,5-thiadiazinan-3-yl)ethanoic acid Openeye Name: 2-(5-butyl-6-thioxo-1,3,5-thiadiazinan-3-yl)acetic acid CAS Name: 2-(5-butyl-6-sulfanylidene-1,3,5-thiadiazinan-3-yl)acetic acid IUPAC Name: 2-(5-butyl-6-sulfanylidene-1,3,5-thiadiazinan-3-yl)acetic acid Traditional Name: 2-(5-butyl-6-thioxo-1,3,5-thiadiazinan-3-yl)acetic acid Formula: C9H16N2O2S2 MolecularWeight: 248.36554

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Descriptors Computed from Structure

Canonical SMILES:

CCCCN1CN(CSC1=S)CC(=O)O

Isomeric SMILES

CCCCN1CN(CSC1=S)CC(=O)O

InChI

InChI=1S/C9H16N2O2S2/c1-2-3-4-11-6-10(5-8(12)13)7-15-9(11)14/h2-7H2,1H3,(H,12,13)