1-(4-ethanoyl-3,5-dimethyl-1H-pyrrol-2-yl)-2-[1-(2-methylphenyl)imidazol-2-yl]sulfanyl-ethanone

Systemtic Name: 1-(4-ethanoyl-3,5-dimethyl-1H-pyrrol-2-yl)-2-[1-(2-methylphenyl)imidazol-2-yl]sulfanyl-ethanone Openeye Name: 1-(4-acetyl-3,5-dimethyl-1H-pyrrol-2-yl)-2-[1-(o-tolyl)imidazol-2-yl]sulfanyl-ethanone CAS Name: 1-(4-acetyl-3,5-dimethyl-1H-pyrrol-2-yl)-2-[[1-(2-methylphenyl)-2-imidazolyl]thio]ethanone IUPAC Name: 1-(4-acetyl-3,5-dimethyl-1H-pyrrol-2-yl)-2-[1-(2-methylphenyl)imidazol-2-yl]sulfanylethanone Traditional Name: 1-(4-acetyl-3,5-dimethyl-1H-pyrrol-2-yl)-2-[[1-(o-tolyl)imidazol-2-yl]thio]ethanone Formula: C20H21N3O2S MolecularWeight: 367.46464

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1N2C=CN=C2SCC(=O)C3=C(C(=C(N3)C)C(=O)C)C

Isomeric SMILES

CC1=CC=CC=C1N2C=CN=C2SCC(=O)C3=C(C(=C(N3)C)C(=O)C)C

InChI

InChI=1S/C20H21N3O2S/c1-12-7-5-6-8-16(12)23-10-9-21-20(23)26-11-17(25)19-13(2)18(15(4)24)14(3)22-19/h5-10,22H,11H2,1-4H3