[5-(5-bromanylthiophen-2-yl)-1,3,4-oxadiazol-2-yl]methyl 2-ethyl-4-methyl-quinoline-3-carboxylate

Systemtic Name: [5-(5-bromanylthiophen-2-yl)-1,3,4-oxadiazol-2-yl]methyl 2-ethyl-4-methyl-quinoline-3-carboxylate Openeye Name: [5-(5-bromo-2-thienyl)-1,3,4-oxadiazol-2-yl]methyl 2-ethyl-4-methyl-quinoline-3-carboxylate CAS Name: 2-ethyl-4-methyl-3-quinolinecarboxylic acid [5-(5-bromo-2-thiophenyl)-1,3,4-oxadiazol-2-yl]methyl ester IUPAC Name: [5-(5-bromothiophen-2-yl)-1,3,4-oxadiazol-2-yl]methyl 2-ethyl-4-methylquinoline-3-carboxylate Traditional Name: 2-ethyl-4-methyl-quinoline-3-carboxylic acid [5-(5-bromo-2-thienyl)-1,3,4-oxadiazol-2-yl]methyl ester Formula: C20H16BrN3O3S MolecularWeight: 458.32834

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCC1=NC2=CC=CC=C2C(=C1C(=O)OCC3=NN=C(O3)C4=CC=C(S4)Br)C

Isomeric SMILES

CCC1=NC2=CC=CC=C2C(=C1C(=O)OCC3=NN=C(O3)C4=CC=C(S4)Br)C

InChI

InChI=1S/C20H16BrN3O3S/c1-3-13-18(11(2)12-6-4-5-7-14(12)22-13)20(25)26-10-17-23-24-19(27-17)15-8-9-16(21)28-15/h4-9H,3,10H2,1-2H3