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

Systemtic Name: 3-[(E)-(1-butyl-5-oxidanylidene-2-sulfanylidene-imidazolidin-4-ylidene)methyl]benzenecarbonitrile Openeye Name: 3-[(E)-(1-butyl-5-oxo-2-thioxo-imidazolidin-4-ylidene)methyl]benzonitrile CAS Name: 3-[(E)-(1-butyl-5-oxo-2-sulfanylidene-4-imidazolidinylidene)methyl]benzonitrile IUPAC Name: 3-[(E)-(1-butyl-5-oxo-2-sulfanylideneimidazolidin-4-ylidene)methyl]benzonitrile Traditional Name: 3-[(E)-(1-butyl-5-keto-2-thioxo-imidazolidin-4-ylidene)methyl]benzonitrile Formula: C15H15N3OS MolecularWeight: 285.3641

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Descriptors Computed from Structure

Canonical SMILES:

CCCCN1C(=O)C(=CC2=CC=CC(=C2)C#N)NC1=S

Isomeric SMILES

CCCCN1C(=O)/C(=C\C2=CC=CC(=C2)C#N)/NC1=S

InChI

InChI=1S/C15H15N3OS/c1-2-3-7-18-14(19)13(17-15(18)20)9-11-5-4-6-12(8-11)10-16/h4-6,8-9H,2-3,7H2,1H3,(H,17,20)/b13-9+