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

Systemtic Name: 1-[2,5-dimethyl-1-(5-methyl-1,2-oxazol-3-yl)pyrrol-3-yl]-2-(1-ethylbenzimidazol-2-yl)sulfanyl-ethanone Openeye Name: 1-[2,5-dimethyl-1-(5-methylisoxazol-3-yl)pyrrol-3-yl]-2-(1-ethylbenzimidazol-2-yl)sulfanyl-ethanone CAS Name: 1-[2,5-dimethyl-1-(5-methyl-3-isoxazolyl)-3-pyrrolyl]-2-[(1-ethyl-2-benzimidazolyl)thio]ethanone IUPAC Name: 1-[2,5-dimethyl-1-(5-methyl-1,2-oxazol-3-yl)pyrrol-3-yl]-2-(1-ethylbenzimidazol-2-yl)sulfanylethanone Traditional Name: 1-[2,5-dimethyl-1-(5-methylisoxazol-3-yl)pyrrol-3-yl]-2-[(1-ethylbenzimidazol-2-yl)thio]ethanone Formula: C21H22N4O2S MolecularWeight: 394.48998

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCN1C2=CC=CC=C2N=C1SCC(=O)C3=C(N(C(=C3)C)C4=NOC(=C4)C)C

Isomeric SMILES

CCN1C2=CC=CC=C2N=C1SCC(=O)C3=C(N(C(=C3)C)C4=NOC(=C4)C)C

InChI

InChI=1S/C21H22N4O2S/c1-5-24-18-9-7-6-8-17(18)22-21(24)28-12-19(26)16-10-13(2)25(15(16)4)20-11-14(3)27-23-20/h6-11H,5,12H2,1-4H3