(3-thiophen-3-yl-1,2,4-oxadiazol-5-yl)methyl 2-ethyl-4-methyl-quinoline-3-carboxylate

Systemtic Name: (3-thiophen-3-yl-1,2,4-oxadiazol-5-yl)methyl 2-ethyl-4-methyl-quinoline-3-carboxylate Openeye Name: [3-(3-thienyl)-1,2,4-oxadiazol-5-yl]methyl 2-ethyl-4-methyl-quinoline-3-carboxylate CAS Name: 2-ethyl-4-methyl-3-quinolinecarboxylic acid [3-(3-thiophenyl)-1,2,4-oxadiazol-5-yl]methyl ester IUPAC Name: (3-thiophen-3-yl-1,2,4-oxadiazol-5-yl)methyl 2-ethyl-4-methylquinoline-3-carboxylate Traditional Name: 2-ethyl-4-methyl-quinoline-3-carboxylic acid [3-(3-thienyl)-1,2,4-oxadiazol-5-yl]methyl ester Formula: C20H17N3O3S MolecularWeight: 379.43228

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=NC2=CC=CC=C2C(=C1C(=O)OCC3=NC(=NO3)C4=CSC=C4)C

Isomeric SMILES

CCC1=NC2=CC=CC=C2C(=C1C(=O)OCC3=NC(=NO3)C4=CSC=C4)C

InChI

InChI=1S/C20H17N3O3S/c1-3-15-18(12(2)14-6-4-5-7-16(14)21-15)20(24)25-10-17-22-19(23-26-17)13-8-9-27-11-13/h4-9,11H,3,10H2,1-2H3