1-[2,5-dimethyl-1-(5-methyl-1,2-oxazol-3-yl)pyrrol-3-yl]-2-[(5-phenyl-1H-imidazol-2-yl)sulfanyl]ethanone

Systemtic Name: 1-[2,5-dimethyl-1-(5-methyl-1,2-oxazol-3-yl)pyrrol-3-yl]-2-[(5-phenyl-1H-imidazol-2-yl)sulfanyl]ethanone Openeye Name: 1-[2,5-dimethyl-1-(5-methylisoxazol-3-yl)pyrrol-3-yl]-2-[(5-phenyl-1H-imidazol-2-yl)sulfanyl]ethanone CAS Name: 1-[2,5-dimethyl-1-(5-methyl-3-isoxazolyl)-3-pyrrolyl]-2-[(5-phenyl-1H-imidazol-2-yl)thio]ethanone IUPAC Name: 1-[2,5-dimethyl-1-(5-methyl-1,2-oxazol-3-yl)pyrrol-3-yl]-2-[(5-phenyl-1H-imidazol-2-yl)sulfanyl]ethanone Traditional Name: 1-[2,5-dimethyl-1-(5-methylisoxazol-3-yl)pyrrol-3-yl]-2-[(5-phenyl-1H-imidazol-2-yl)thio]ethanone Formula: C21H20N4O2S MolecularWeight: 392.4741

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(N1C2=NOC(=C2)C)C)C(=O)CSC3=NC=C(N3)C4=CC=CC=C4

Isomeric SMILES

CC1=CC(=C(N1C2=NOC(=C2)C)C)C(=O)CSC3=NC=C(N3)C4=CC=CC=C4

InChI

InChI=1S/C21H20N4O2S/c1-13-9-17(15(3)25(13)20-10-14(2)27-24-20)19(26)12-28-21-22-11-18(23-21)16-7-5-4-6-8-16/h4-11H,12H2,1-3H3,(H,22,23)