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

Systemtic Name: 1-(4-ethanoyl-3,5-dimethyl-1H-pyrrol-2-yl)-2-[1-(2-methylphenyl)imidazol-2-yl]sulfanyl-propan-1-one Openeye Name: 1-(4-acetyl-3,5-dimethyl-1H-pyrrol-2-yl)-2-[1-(o-tolyl)imidazol-2-yl]sulfanyl-propan-1-one CAS Name: 1-(4-acetyl-3,5-dimethyl-1H-pyrrol-2-yl)-2-[[1-(2-methylphenyl)-2-imidazolyl]thio]-1-propanone IUPAC Name: 1-(4-acetyl-3,5-dimethyl-1H-pyrrol-2-yl)-2-[1-(2-methylphenyl)imidazol-2-yl]sulfanylpropan-1-one Traditional Name: 1-(4-acetyl-3,5-dimethyl-1H-pyrrol-2-yl)-2-[[1-(o-tolyl)imidazol-2-yl]thio]propan-1-one Formula: C21H23N3O2S MolecularWeight: 381.49122

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1N2C=CN=C2SC(C)C(=O)C3=C(C(=C(N3)C)C(=O)C)C

Isomeric SMILES

CC1=CC=CC=C1N2C=CN=C2SC(C)C(=O)C3=C(C(=C(N3)C)C(=O)C)C

InChI

InChI=1S/C21H23N3O2S/c1-12-8-6-7-9-17(12)24-11-10-22-21(24)27-16(5)20(26)19-13(2)18(15(4)25)14(3)23-19/h6-11,16,23H,1-5H3