1-[2-[[4-(furan-2-ylmethylsulfanyl)-3-methyl-pyridin-2-yl]methylsulfanyl]benzimidazol-1-yl]prop-2-en-1-one

Systemtic Name: 1-[2-[[4-(furan-2-ylmethylsulfanyl)-3-methyl-pyridin-2-yl]methylsulfanyl]benzimidazol-1-yl]prop-2-en-1-one Openeye Name: 1-[2-[[4-(2-furylmethylsulfanyl)-3-methyl-2-pyridyl]methylsulfanyl]benzimidazol-1-yl]prop-2-en-1-one CAS Name: 1-[2-[[4-(2-furanylmethylthio)-3-methyl-2-pyridinyl]methylthio]-1-benzimidazolyl]-2-propen-1-one IUPAC Name: 1-[2-[[4-(furan-2-ylmethylsulfanyl)-3-methylpyridin-2-yl]methylsulfanyl]benzimidazol-1-yl]prop-2-en-1-one Traditional Name: 1-[2-[[4-(2-furfurylthio)-3-methyl-2-pyridyl]methylthio]benzimidazol-1-yl]prop-2-en-1-one Formula: C22H19N3O2S2 MolecularWeight: 421.53516

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CN=C1CSC2=NC3=CC=CC=C3N2C(=O)C=C)SCC4=CC=CO4

Isomeric SMILES

CC1=C(C=CN=C1CSC2=NC3=CC=CC=C3N2C(=O)C=C)SCC4=CC=CO4

InChI

InChI=1S/C22H19N3O2S2/c1-3-21(26)25-19-9-5-4-8-17(19)24-22(25)29-14-18-15(2)20(10-11-23-18)28-13-16-7-6-12-27-16/h3-12H,1,13-14H2,2H3