3-[[(4E)-1-(3-chloranyl-4-methoxy-phenyl)-4-(furan-2-ylmethylidene)-5-oxidanylidene-imidazol-2-yl]sulfanylmethyl]benzenecarbonitrile

Systemtic Name: 3-[[(4E)-1-(3-chloranyl-4-methoxy-phenyl)-4-(furan-2-ylmethylidene)-5-oxidanylidene-imidazol-2-yl]sulfanylmethyl]benzenecarbonitrile Openeye Name: 3-[[(4E)-1-(3-chloro-4-methoxy-phenyl)-4-(2-furylmethylene)-5-oxo-imidazol-2-yl]sulfanylmethyl]benzonitrile CAS Name: 3-[[[(4E)-1-(3-chloro-4-methoxyphenyl)-4-(2-furanylmethylidene)-5-oxo-2-imidazolyl]thio]methyl]benzonitrile IUPAC Name: 3-[[(4E)-1-(3-chloro-4-methoxyphenyl)-4-(furan-2-ylmethylidene)-5-oxoimidazol-2-yl]sulfanylmethyl]benzonitrile Traditional Name: 3-[[[(4E)-1-(3-chloro-4-methoxy-phenyl)-4-(2-furfurylidene)-5-keto-2-imidazolin-2-yl]thio]methyl]benzonitrile Formula: C23H16ClN3O3S MolecularWeight: 449.90944

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)N2C(=O)C(=CC3=CC=CO3)N=C2SCC4=CC=CC(=C4)C#N)Cl

Isomeric SMILES

COC1=C(C=C(C=C1)N2C(=O)/C(=C\C3=CC=CO3)/N=C2SCC4=CC=CC(=C4)C#N)Cl

InChI

InChI=1S/C23H16ClN3O3S/c1-29-21-8-7-17(11-19(21)24)27-22(28)20(12-18-6-3-9-30-18)26-23(27)31-14-16-5-2-4-15(10-16)13-25/h2-12H,14H2,1H3/b20-12+