(3-thiophen-3-yl-1,2,4-oxadiazol-5-yl)methyl 2,6-dimethylquinoline-4-carboxylate

Systemtic Name: (3-thiophen-3-yl-1,2,4-oxadiazol-5-yl)methyl 2,6-dimethylquinoline-4-carboxylate Openeye Name: [3-(3-thienyl)-1,2,4-oxadiazol-5-yl]methyl 2,6-dimethylquinoline-4-carboxylate CAS Name: 2,6-dimethyl-4-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 2,6-dimethylquinoline-4-carboxylate Traditional Name: 2,6-dimethylcinchoninic acid [3-(3-thienyl)-1,2,4-oxadiazol-5-yl]methyl ester Formula: C19H15N3O3S MolecularWeight: 365.4057

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC2=C(C=C1)N=C(C=C2C(=O)OCC3=NC(=NO3)C4=CSC=C4)C

Isomeric SMILES

CC1=CC2=C(C=C1)N=C(C=C2C(=O)OCC3=NC(=NO3)C4=CSC=C4)C

InChI

InChI=1S/C19H15N3O3S/c1-11-3-4-16-14(7-11)15(8-12(2)20-16)19(23)24-9-17-21-18(22-25-17)13-5-6-26-10-13/h3-8,10H,9H2,1-2H3