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

Systemtic Name: 4-[(4E)-1-(3-chloranyl-4-methoxy-phenyl)-4-(furan-2-ylmethylidene)-5-oxidanylidene-imidazol-2-yl]sulfanylbutanenitrile Openeye Name: 4-[(4E)-1-(3-chloro-4-methoxy-phenyl)-4-(2-furylmethylene)-5-oxo-imidazol-2-yl]sulfanylbutanenitrile CAS Name: 4-[[(4E)-1-(3-chloro-4-methoxyphenyl)-4-(2-furanylmethylidene)-5-oxo-2-imidazolyl]thio]butanenitrile IUPAC Name: 4-[(4E)-1-(3-chloro-4-methoxyphenyl)-4-(furan-2-ylmethylidene)-5-oxoimidazol-2-yl]sulfanylbutanenitrile Traditional Name: 4-[[(4E)-1-(3-chloro-4-methoxy-phenyl)-4-(2-furfurylidene)-5-keto-2-imidazolin-2-yl]thio]butyronitrile Formula: C19H16ClN3O3S MolecularWeight: 401.86664

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)N2C(=O)C(=CC3=CC=CO3)N=C2SCCCC#N)Cl

Isomeric SMILES

COC1=C(C=C(C=C1)N2C(=O)/C(=C\C3=CC=CO3)/N=C2SCCCC#N)Cl

InChI

InChI=1S/C19H16ClN3O3S/c1-25-17-7-6-13(11-15(17)20)23-18(24)16(12-14-5-4-9-26-14)22-19(23)27-10-3-2-8-21/h4-7,9,11-12H,2-3,10H2,1H3/b16-12+