2-[3,4,5-tris(oxidanyl)thian-2-yl]sulfanylbenzene-1,3,5-tricarbonitrile

Systemtic Name: 2-[3,4,5-tris(oxidanyl)thian-2-yl]sulfanylbenzene-1,3,5-tricarbonitrile Openeye Name: 2-(3,4,5-trihydroxytetrahydrothiopyran-2-yl)sulfanylbenzene-1,3,5-tricarbonitrile CAS Name: 2-[(3,4,5-trihydroxy-2-thianyl)thio]benzene-1,3,5-tricarbonitrile IUPAC Name: 2-(3,4,5-trihydroxythian-2-yl)sulfanylbenzene-1,3,5-tricarbonitrile Traditional Name: 2-[(3,4,5-trihydroxytetrahydrothiopyran-2-yl)thio]benzene-1,3,5-tricarbonitrile Formula: C14H11N3O3S2 MolecularWeight: 333.38544

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Descriptors Computed from Structure

Canonical SMILES:

C1C(C(C(C(S1)SC2=C(C=C(C=C2C#N)C#N)C#N)O)O)O

Isomeric SMILES

C1C(C(C(C(S1)SC2=C(C=C(C=C2C#N)C#N)C#N)O)O)O

InChI

InChI=1S/C14H11N3O3S2/c15-3-7-1-8(4-16)13(9(2-7)5-17)22-14-12(20)11(19)10(18)6-21-14/h1-2,10-12,14,18-20H,6H2