4-[(Z)-[1-(3-imidazol-1-ylpropyl)-5-oxidanylidene-2-sulfanylidene-imidazolidin-4-ylidene]methyl]benzenecarbonitrile

Systemtic Name: 4-[(Z)-[1-(3-imidazol-1-ylpropyl)-5-oxidanylidene-2-sulfanylidene-imidazolidin-4-ylidene]methyl]benzenecarbonitrile Openeye Name: 4-[(Z)-[1-(3-imidazol-1-ylpropyl)-5-oxo-2-thioxo-imidazolidin-4-ylidene]methyl]benzonitrile CAS Name: 4-[(Z)-[1-[3-(1-imidazolyl)propyl]-5-oxo-2-sulfanylidene-4-imidazolidinylidene]methyl]benzonitrile IUPAC Name: 4-[(Z)-[1-(3-imidazol-1-ylpropyl)-5-oxo-2-sulfanylideneimidazolidin-4-ylidene]methyl]benzonitrile Traditional Name: 4-[(Z)-[1-(3-imidazol-1-ylpropyl)-5-keto-2-thioxo-imidazolidin-4-ylidene]methyl]benzonitrile Formula: C17H15N5OS MolecularWeight: 337.3989

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1C=C2C(=O)N(C(=S)N2)CCCN3C=CN=C3)C#N

Isomeric SMILES

C1=CC(=CC=C1/C=C\2/C(=O)N(C(=S)N2)CCCN3C=CN=C3)C#N

InChI

InChI=1S/C17H15N5OS/c18-11-14-4-2-13(3-5-14)10-15-16(23)22(17(24)20-15)8-1-7-21-9-6-19-12-21/h2-6,9-10,12H,1,7-8H2,(H,20,24)/b15-10-