1-[6-(hydroxymethyl)-3,4,5-tris(oxidanyl)oxan-2-yl]-5,6-dimethyl-2-sulfanylidene-pyridine-3-carbonitrile

Systemtic Name: 1-[6-(hydroxymethyl)-3,4,5-tris(oxidanyl)oxan-2-yl]-5,6-dimethyl-2-sulfanylidene-pyridine-3-carbonitrile Openeye Name: 5,6-dimethyl-2-thioxo-1-[3,4,5-trihydroxy-6-(hydroxymethyl)tetrahydropyran-2-yl]pyridine-3-carbonitrile CAS Name: 5,6-dimethyl-2-sulfanylidene-1-[3,4,5-trihydroxy-6-(hydroxymethyl)-2-oxanyl]-3-pyridinecarbonitrile IUPAC Name: 5,6-dimethyl-2-sulfanylidene-1-[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]pyridine-3-carbonitrile Traditional Name: 5,6-dimethyl-2-thioxo-1-(3,4,5-trihydroxy-6-methylol-tetrahydropyran-2-yl)nicotinonitrile Formula: C14H18N2O5S MolecularWeight: 326.36812

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(N(C(=S)C(=C1)C#N)C2C(C(C(C(O2)CO)O)O)O)C

Isomeric SMILES

CC1=C(N(C(=S)C(=C1)C#N)C2C(C(C(C(O2)CO)O)O)O)C

InChI

InChI=1S/C14H18N2O5S/c1-6-3-8(4-15)14(22)16(7(6)2)13-12(20)11(19)10(18)9(5-17)21-13/h3,9-13,17-20H,5H2,1-2H3