4-[(E)-[1-(3-methylphenyl)-5-oxidanylidene-2-sulfanylidene-imidazolidin-4-ylidene]methyl]benzenecarbonitrile

Systemtic Name: 4-[(E)-[1-(3-methylphenyl)-5-oxidanylidene-2-sulfanylidene-imidazolidin-4-ylidene]methyl]benzenecarbonitrile Openeye Name: 4-[(E)-[1-(m-tolyl)-5-oxo-2-thioxo-imidazolidin-4-ylidene]methyl]benzonitrile CAS Name: 4-[(E)-[1-(3-methylphenyl)-5-oxo-2-sulfanylidene-4-imidazolidinylidene]methyl]benzonitrile IUPAC Name: 4-[(E)-[1-(3-methylphenyl)-5-oxo-2-sulfanylideneimidazolidin-4-ylidene]methyl]benzonitrile Traditional Name: 4-[(E)-[5-keto-1-(m-tolyl)-2-thioxo-imidazolidin-4-ylidene]methyl]benzonitrile Formula: C18H13N3OS MolecularWeight: 319.38032

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC=C1)N2C(=O)C(=CC3=CC=C(C=C3)C#N)NC2=S

Isomeric SMILES

CC1=CC(=CC=C1)N2C(=O)/C(=C\C3=CC=C(C=C3)C#N)/NC2=S

InChI

InChI=1S/C18H13N3OS/c1-12-3-2-4-15(9-12)21-17(22)16(20-18(21)23)10-13-5-7-14(11-19)8-6-13/h2-10H,1H3,(H,20,23)/b16-10+