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

Systemtic Name: 3-[(4E)-1-(3-chloranyl-4-methoxy-phenyl)-4-(furan-2-ylmethylidene)-5-oxidanylidene-imidazol-2-yl]sulfanylpropanenitrile Openeye Name: 3-[(4E)-1-(3-chloro-4-methoxy-phenyl)-4-(2-furylmethylene)-5-oxo-imidazol-2-yl]sulfanylpropanenitrile CAS Name: 3-[[(4E)-1-(3-chloro-4-methoxyphenyl)-4-(2-furanylmethylidene)-5-oxo-2-imidazolyl]thio]propanenitrile IUPAC Name: 3-[(4E)-1-(3-chloro-4-methoxyphenyl)-4-(furan-2-ylmethylidene)-5-oxoimidazol-2-yl]sulfanylpropanenitrile Traditional Name: 3-[[(4E)-1-(3-chloro-4-methoxy-phenyl)-4-(2-furfurylidene)-5-keto-2-imidazolin-2-yl]thio]propionitrile Formula: C18H14ClN3O3S MolecularWeight: 387.84006

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)N2C(=O)C(=CC3=CC=CO3)N=C2SCCC#N)Cl

Isomeric SMILES

COC1=C(C=C(C=C1)N2C(=O)/C(=C\C3=CC=CO3)/N=C2SCCC#N)Cl

InChI

InChI=1S/C18H14ClN3O3S/c1-24-16-6-5-12(10-14(16)19)22-17(23)15(11-13-4-2-8-25-13)21-18(22)26-9-3-7-20/h2,4-6,8,10-11H,3,9H2,1H3/b15-11+