1-(2,5-dimethyl-1-propan-2-yl-pyrrol-3-yl)-2-(1-methylbenzimidazol-2-yl)sulfanyl-ethanone

Systemtic Name: 1-(2,5-dimethyl-1-propan-2-yl-pyrrol-3-yl)-2-(1-methylbenzimidazol-2-yl)sulfanyl-ethanone Openeye Name: 1-(1-isopropyl-2,5-dimethyl-pyrrol-3-yl)-2-(1-methylbenzimidazol-2-yl)sulfanyl-ethanone CAS Name: 1-(2,5-dimethyl-1-propan-2-yl-3-pyrrolyl)-2-[(1-methyl-2-benzimidazolyl)thio]ethanone IUPAC Name: 1-(2,5-dimethyl-1-propan-2-ylpyrrol-3-yl)-2-(1-methylbenzimidazol-2-yl)sulfanylethanone Traditional Name: 1-(1-isopropyl-2,5-dimethyl-pyrrol-3-yl)-2-[(1-methylbenzimidazol-2-yl)thio]ethanone Formula: C19H23N3OS MolecularWeight: 341.47042

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(N1C(C)C)C)C(=O)CSC2=NC3=CC=CC=C3N2C

Isomeric SMILES

CC1=CC(=C(N1C(C)C)C)C(=O)CSC2=NC3=CC=CC=C3N2C

InChI

InChI=1S/C19H23N3OS/c1-12(2)22-13(3)10-15(14(22)4)18(23)11-24-19-20-16-8-6-7-9-17(16)21(19)5/h6-10,12H,11H2,1-5H3