4,5-bis[(1-methylimidazol-2-yl)sulfanyl]benzene-1,2-dicarbonitrile

Systemtic Name: 4,5-bis[(1-methylimidazol-2-yl)sulfanyl]benzene-1,2-dicarbonitrile Openeye Name: 4,5-bis[(1-methylimidazol-2-yl)sulfanyl]phthalonitrile CAS Name: 4,5-bis[(1-methyl-2-imidazolyl)thio]benzene-1,2-dicarbonitrile IUPAC Name: 4,5-bis[(1-methylimidazol-2-yl)sulfanyl]benzene-1,2-dicarbonitrile Traditional Name: 4,5-bis[(1-methylimidazol-2-yl)thio]phthalonitrile Formula: C16H12N6S2 MolecularWeight: 352.43668

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Descriptors Computed from Structure

Canonical SMILES:

CN1C=CN=C1SC2=C(C=C(C(=C2)C#N)C#N)SC3=NC=CN3C

Isomeric SMILES

CN1C=CN=C1SC2=C(C=C(C(=C2)C#N)C#N)SC3=NC=CN3C

InChI

InChI=1S/C16H12N6S2/c1-21-5-3-19-15(21)23-13-7-11(9-17)12(10-18)8-14(13)24-16-20-4-6-22(16)2/h3-8H,1-2H3