methyl 2-[[furan-2-ylmethyl(thiophen-2-ylmethyl)amino]methyl]-4-methyl-quinoline-3-carboxylate

Systemtic Name: methyl 2-[[furan-2-ylmethyl(thiophen-2-ylmethyl)amino]methyl]-4-methyl-quinoline-3-carboxylate Openeye Name: methyl 2-[[2-furylmethyl(2-thienylmethyl)amino]methyl]-4-methyl-quinoline-3-carboxylate CAS Name: 2-[[2-furanylmethyl(thiophen-2-ylmethyl)amino]methyl]-4-methyl-3-quinolinecarboxylic acid methyl ester IUPAC Name: methyl 2-[[furan-2-ylmethyl(thiophen-2-ylmethyl)amino]methyl]-4-methylquinoline-3-carboxylate Traditional Name: 2-[[2-furfuryl(2-thenyl)amino]methyl]-4-methyl-quinoline-3-carboxylic acid methyl ester Formula: C23H22N2O3S MolecularWeight: 406.49738

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=NC2=CC=CC=C12)CN(CC3=CC=CO3)CC4=CC=CS4)C(=O)OC

Isomeric SMILES

CC1=C(C(=NC2=CC=CC=C12)CN(CC3=CC=CO3)CC4=CC=CS4)C(=O)OC

InChI

InChI=1S/C23H22N2O3S/c1-16-19-9-3-4-10-20(19)24-21(22(16)23(26)27-2)15-25(13-17-7-5-11-28-17)14-18-8-6-12-29-18/h3-12H,13-15H2,1-2H3