2-[[4-[(5-oxidanylidene-2-sulfanylidene-imidazolidin-4-ylidene)methyl]phenoxy]methyl]benzenecarbonitrile

Systemtic Name: 2-[[4-[(5-oxidanylidene-2-sulfanylidene-imidazolidin-4-ylidene)methyl]phenoxy]methyl]benzenecarbonitrile Openeye Name: 2-[[4-[(5-oxo-2-thioxo-imidazolidin-4-ylidene)methyl]phenoxy]methyl]benzonitrile CAS Name: 2-[[4-[(5-oxo-2-sulfanylidene-4-imidazolidinylidene)methyl]phenoxy]methyl]benzonitrile IUPAC Name: 2-[[4-[(5-oxo-2-sulfanylideneimidazolidin-4-ylidene)methyl]phenoxy]methyl]benzonitrile Traditional Name: 2-[[4-[(5-keto-2-thioxo-imidazolidin-4-ylidene)methyl]phenoxy]methyl]benzonitrile Formula: C18H13N3O2S MolecularWeight: 335.37972

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C(=C1)COC2=CC=C(C=C2)C=C3C(=O)NC(=S)N3)C#N

Isomeric SMILES

C1=CC=C(C(=C1)COC2=CC=C(C=C2)C=C3C(=O)NC(=S)N3)C#N

InChI

InChI=1S/C18H13N3O2S/c19-10-13-3-1-2-4-14(13)11-23-15-7-5-12(6-8-15)9-16-17(22)21-18(24)20-16/h1-9H,11H2,(H2,20,21,22,24)