4-(1-butyl-4,5-dimethyl-imidazol-2-yl)sulfanyl-2-(1,3-dihydrobenzimidazol-2-ylidene)-3-oxidanylidene-pentanenitrile

Systemtic Name: 4-(1-butyl-4,5-dimethyl-imidazol-2-yl)sulfanyl-2-(1,3-dihydrobenzimidazol-2-ylidene)-3-oxidanylidene-pentanenitrile Openeye Name: 4-(1-butyl-4,5-dimethyl-imidazol-2-yl)sulfanyl-2-(1,3-dihydrobenzimidazol-2-ylidene)-3-oxo-pentanenitrile CAS Name: 4-[(1-butyl-4,5-dimethyl-2-imidazolyl)thio]-2-(1,3-dihydrobenzimidazol-2-ylidene)-3-oxopentanenitrile IUPAC Name: 4-(1-butyl-4,5-dimethylimidazol-2-yl)sulfanyl-2-(1,3-dihydrobenzimidazol-2-ylidene)-3-oxopentanenitrile Traditional Name: 4-[(1-butyl-4,5-dimethyl-imidazol-2-yl)thio]-2-(1,3-dihydrobenzimidazol-2-ylidene)-3-keto-valeronitrile Formula: C21H25N5OS MolecularWeight: 395.5211

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Descriptors Computed from Structure

Canonical SMILES:

CCCCN1C(=C(N=C1SC(C)C(=O)C(=C2NC3=CC=CC=C3N2)C#N)C)C

Isomeric SMILES

CCCCN1C(=C(N=C1SC(C)C(=O)C(=C2NC3=CC=CC=C3N2)C#N)C)C

InChI

InChI=1S/C21H25N5OS/c1-5-6-11-26-14(3)13(2)23-21(26)28-15(4)19(27)16(12-22)20-24-17-9-7-8-10-18(17)25-20/h7-10,15,24-25H,5-6,11H2,1-4H3