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

Systemtic Name: 1-(1-cyclopropyl-2,5-dimethyl-pyrrol-3-yl)-2-[1-(2-methylpropyl)benzimidazol-2-yl]sulfanyl-ethanone Openeye Name: 1-(1-cyclopropyl-2,5-dimethyl-pyrrol-3-yl)-2-(1-isobutylbenzimidazol-2-yl)sulfanyl-ethanone CAS Name: 1-(1-cyclopropyl-2,5-dimethyl-3-pyrrolyl)-2-[[1-(2-methylpropyl)-2-benzimidazolyl]thio]ethanone IUPAC Name: 1-(1-cyclopropyl-2,5-dimethylpyrrol-3-yl)-2-[1-(2-methylpropyl)benzimidazol-2-yl]sulfanylethanone Traditional Name: 1-(1-cyclopropyl-2,5-dimethyl-pyrrol-3-yl)-2-[(1-isobutylbenzimidazol-2-yl)thio]ethanone Formula: C22H27N3OS MolecularWeight: 381.53428

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(N1C2CC2)C)C(=O)CSC3=NC4=CC=CC=C4N3CC(C)C

Isomeric SMILES

CC1=CC(=C(N1C2CC2)C)C(=O)CSC3=NC4=CC=CC=C4N3CC(C)C

InChI

InChI=1S/C22H27N3OS/c1-14(2)12-24-20-8-6-5-7-19(20)23-22(24)27-13-21(26)18-11-15(3)25(16(18)4)17-9-10-17/h5-8,11,14,17H,9-10,12-13H2,1-4H3