1-[1-(furan-2-ylmethyl)-2,5-dimethyl-pyrrol-3-yl]-2-[1-(2-methylpropyl)benzimidazol-2-yl]sulfanyl-ethanone

Systemtic Name: 1-[1-(furan-2-ylmethyl)-2,5-dimethyl-pyrrol-3-yl]-2-[1-(2-methylpropyl)benzimidazol-2-yl]sulfanyl-ethanone Openeye Name: 1-[1-(2-furylmethyl)-2,5-dimethyl-pyrrol-3-yl]-2-(1-isobutylbenzimidazol-2-yl)sulfanyl-ethanone CAS Name: 1-[1-(2-furanylmethyl)-2,5-dimethyl-3-pyrrolyl]-2-[[1-(2-methylpropyl)-2-benzimidazolyl]thio]ethanone IUPAC Name: 1-[1-(furan-2-ylmethyl)-2,5-dimethylpyrrol-3-yl]-2-[1-(2-methylpropyl)benzimidazol-2-yl]sulfanylethanone Traditional Name: 1-[1-(2-furfuryl)-2,5-dimethyl-pyrrol-3-yl]-2-[(1-isobutylbenzimidazol-2-yl)thio]ethanone Formula: C24H27N3O2S MolecularWeight: 421.55508

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(N1CC2=CC=CO2)C)C(=O)CSC3=NC4=CC=CC=C4N3CC(C)C

Isomeric SMILES

CC1=CC(=C(N1CC2=CC=CO2)C)C(=O)CSC3=NC4=CC=CC=C4N3CC(C)C

InChI

InChI=1S/C24H27N3O2S/c1-16(2)13-27-22-10-6-5-9-21(22)25-24(27)30-15-23(28)20-12-17(3)26(18(20)4)14-19-8-7-11-29-19/h5-12,16H,13-15H2,1-4H3