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

Systemtic Name: (2-thiophen-3-yl-1,3-thiazol-4-yl)methyl 2-ethyl-4-methyl-quinoline-3-carboxylate Openeye Name: [2-(3-thienyl)thiazol-4-yl]methyl 2-ethyl-4-methyl-quinoline-3-carboxylate CAS Name: 2-ethyl-4-methyl-3-quinolinecarboxylic acid [2-(3-thiophenyl)-4-thiazolyl]methyl ester IUPAC Name: (2-thiophen-3-yl-1,3-thiazol-4-yl)methyl 2-ethyl-4-methylquinoline-3-carboxylate Traditional Name: 2-ethyl-4-methyl-quinoline-3-carboxylic acid [2-(3-thienyl)thiazol-4-yl]methyl ester Formula: C21H18N2O2S2 MolecularWeight: 394.50982

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=NC2=CC=CC=C2C(=C1C(=O)OCC3=CSC(=N3)C4=CSC=C4)C

Isomeric SMILES

CCC1=NC2=CC=CC=C2C(=C1C(=O)OCC3=CSC(=N3)C4=CSC=C4)C

InChI

InChI=1S/C21H18N2O2S2/c1-3-17-19(13(2)16-6-4-5-7-18(16)23-17)21(24)25-10-15-12-27-20(22-15)14-8-9-26-11-14/h4-9,11-12H,3,10H2,1-2H3