6-[5-(furan-2-ylcarbonyl)-6-sulfanylidene-1,3,5-thiadiazinan-3-yl]hexanoic acid

Systemtic Name: 6-[5-(furan-2-ylcarbonyl)-6-sulfanylidene-1,3,5-thiadiazinan-3-yl]hexanoic acid Openeye Name: 6-[5-(furan-2-carbonyl)-6-thioxo-1,3,5-thiadiazinan-3-yl]hexanoic acid CAS Name: 6-[5-[2-furanyl(oxo)methyl]-6-sulfanylidene-1,3,5-thiadiazinan-3-yl]hexanoic acid IUPAC Name: 6-[5-(furan-2-carbonyl)-6-sulfanylidene-1,3,5-thiadiazinan-3-yl]hexanoic acid Traditional Name: 6-[5-(2-furoyl)-6-thioxo-1,3,5-thiadiazinan-3-yl]hexanoic acid Formula: C14H18N2O4S2 MolecularWeight: 342.43372

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Descriptors Computed from Structure

Canonical SMILES:

C1N(CSC(=S)N1C(=O)C2=CC=CO2)CCCCCC(=O)O

Isomeric SMILES

C1N(CSC(=S)N1C(=O)C2=CC=CO2)CCCCCC(=O)O

InChI

InChI=1S/C14H18N2O4S2/c17-12(18)6-2-1-3-7-15-9-16(14(21)22-10-15)13(19)11-5-4-8-20-11/h4-5,8H,1-3,6-7,9-10H2,(H,17,18)