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

Systemtic Name: ethyl 4-methyl-2-[(5-pyridin-3-yl-1,3,4-oxadiazol-2-yl)sulfanylmethyl]quinoline-3-carboxylate Openeye Name: ethyl 4-methyl-2-[[5-(3-pyridyl)-1,3,4-oxadiazol-2-yl]sulfanylmethyl]quinoline-3-carboxylate CAS Name: 4-methyl-2-[[[5-(3-pyridinyl)-1,3,4-oxadiazol-2-yl]thio]methyl]-3-quinolinecarboxylic acid ethyl ester IUPAC Name: ethyl 4-methyl-2-[(5-pyridin-3-yl-1,3,4-oxadiazol-2-yl)sulfanylmethyl]quinoline-3-carboxylate Traditional Name: 4-methyl-2-[[[5-(3-pyridyl)-1,3,4-oxadiazol-2-yl]thio]methyl]quinoline-3-carboxylic acid ethyl ester Formula: C21H18N4O3S MolecularWeight: 406.45762

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(C2=CC=CC=C2N=C1CSC3=NN=C(O3)C4=CN=CC=C4)C

Isomeric SMILES

CCOC(=O)C1=C(C2=CC=CC=C2N=C1CSC3=NN=C(O3)C4=CN=CC=C4)C

InChI

InChI=1S/C21H18N4O3S/c1-3-27-20(26)18-13(2)15-8-4-5-9-16(15)23-17(18)12-29-21-25-24-19(28-21)14-7-6-10-22-11-14/h4-11H,3,12H2,1-2H3