2-[1-(2-methylphenyl)imidazol-2-yl]sulfanyl-1-(5-pyrrolidin-1-ylcarbonyl-1H-pyrrol-3-yl)ethanone

Systemtic Name: 2-[1-(2-methylphenyl)imidazol-2-yl]sulfanyl-1-(5-pyrrolidin-1-ylcarbonyl-1H-pyrrol-3-yl)ethanone Openeye Name: 2-[1-(o-tolyl)imidazol-2-yl]sulfanyl-1-[5-(pyrrolidine-1-carbonyl)-1H-pyrrol-3-yl]ethanone CAS Name: 2-[[1-(2-methylphenyl)-2-imidazolyl]thio]-1-[5-[oxo(1-pyrrolidinyl)methyl]-1H-pyrrol-3-yl]ethanone IUPAC Name: 2-[1-(2-methylphenyl)imidazol-2-yl]sulfanyl-1-[5-(pyrrolidine-1-carbonyl)-1H-pyrrol-3-yl]ethanone Traditional Name: 2-[[1-(o-tolyl)imidazol-2-yl]thio]-1-[5-(pyrrolidine-1-carbonyl)-1H-pyrrol-3-yl]ethanone Formula: C21H22N4O2S MolecularWeight: 394.48998

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1N2C=CN=C2SCC(=O)C3=CNC(=C3)C(=O)N4CCCC4

Isomeric SMILES

CC1=CC=CC=C1N2C=CN=C2SCC(=O)C3=CNC(=C3)C(=O)N4CCCC4

InChI

InChI=1S/C21H22N4O2S/c1-15-6-2-3-7-18(15)25-11-8-22-21(25)28-14-19(26)16-12-17(23-13-16)20(27)24-9-4-5-10-24/h2-3,6-8,11-13,23H,4-5,9-10,14H2,1H3