1-[2,5-dimethyl-1-[[(2R)-oxolan-2-yl]methyl]pyrrol-3-yl]-2-(2-methylsulfanylbenzimidazol-1-yl)ethanone

Systemtic Name: 1-[2,5-dimethyl-1-[[(2R)-oxolan-2-yl]methyl]pyrrol-3-yl]-2-(2-methylsulfanylbenzimidazol-1-yl)ethanone Openeye Name: 1-[2,5-dimethyl-1-[[(2R)-tetrahydrofuran-2-yl]methyl]pyrrol-3-yl]-2-(2-methylsulfanylbenzimidazol-1-yl)ethanone CAS Name: 1-[2,5-dimethyl-1-[[(2R)-2-oxolanyl]methyl]-3-pyrrolyl]-2-[2-(methylthio)-1-benzimidazolyl]ethanone IUPAC Name: 1-[2,5-dimethyl-1-[[(2R)-oxolan-2-yl]methyl]pyrrol-3-yl]-2-(2-methylsulfanylbenzimidazol-1-yl)ethanone Traditional Name: 1-[2,5-dimethyl-1-[[(2R)-tetrahydrofuran-2-yl]methyl]pyrrol-3-yl]-2-[2-(methylthio)benzimidazol-1-yl]ethanone Formula: C21H25N3O2S MolecularWeight: 383.5071

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(N1CC2CCCO2)C)C(=O)CN3C4=CC=CC=C4N=C3SC

Isomeric SMILES

CC1=CC(=C(N1C[C@H]2CCCO2)C)C(=O)CN3C4=CC=CC=C4N=C3SC

InChI

InChI=1S/C21H25N3O2S/c1-14-11-17(15(2)23(14)12-16-7-6-10-26-16)20(25)13-24-19-9-5-4-8-18(19)22-21(24)27-3/h4-5,8-9,11,16H,6-7,10,12-13H2,1-3H3/t16-/m1/s1