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

Systemtic Name: 1-[2-[[4-(furan-2-ylmethylsulfanyl)-3-methyl-pyridin-2-yl]methylsulfanyl]benzimidazol-1-yl]ethanone Openeye Name: 1-[2-[[4-(2-furylmethylsulfanyl)-3-methyl-2-pyridyl]methylsulfanyl]benzimidazol-1-yl]ethanone CAS Name: 1-[2-[[4-(2-furanylmethylthio)-3-methyl-2-pyridinyl]methylthio]-1-benzimidazolyl]ethanone IUPAC Name: 1-[2-[[4-(furan-2-ylmethylsulfanyl)-3-methylpyridin-2-yl]methylsulfanyl]benzimidazol-1-yl]ethanone Traditional Name: 1-[2-[[4-(2-furfurylthio)-3-methyl-2-pyridyl]methylthio]benzimidazol-1-yl]ethanone Formula: C21H19N3O2S2 MolecularWeight: 409.52446

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C21H19N3O2S2/c1-14-18(22-10-9-20(14)27-12-16-6-5-11-26-16)13-28-21-23-17-7-3-4-8-19(17)24(21)15(2)25/h3-11H,12-13H2,1-2H3