4-[(2-sulfanylidene-1,3-dihydroimidazol-4-yl)methyl]benzenecarbonitrile

Systemtic Name: 4-[(2-sulfanylidene-1,3-dihydroimidazol-4-yl)methyl]benzenecarbonitrile Openeye Name: 4-[(2-thioxo-1,3-dihydroimidazol-4-yl)methyl]benzonitrile CAS Name: 4-[(2-sulfanylidene-1,3-dihydroimidazol-4-yl)methyl]benzonitrile IUPAC Name: 4-[(2-sulfanylidene-1,3-dihydroimidazol-4-yl)methyl]benzonitrile Traditional Name: 4-[(2-thioxo-4-imidazolin-4-yl)methyl]benzonitrile Formula: C11H9N3S MolecularWeight: 215.27426

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1CC2=CNC(=S)N2)C#N

Isomeric SMILES

C1=CC(=CC=C1CC2=CNC(=S)N2)C#N

InChI

InChI=1S/C11H9N3S/c12-6-9-3-1-8(2-4-9)5-10-7-13-11(15)14-10/h1-4,7H,5H2,(H2,13,14,15)