2-[methyl-[6-methyl-2-(2,3,4-trimethoxyphenyl)quinolin-4-yl]carbothioyl-amino]ethanoic acid

Systemtic Name: 2-[methyl-[6-methyl-2-(2,3,4-trimethoxyphenyl)quinolin-4-yl]carbothioyl-amino]ethanoic acid Openeye Name: 2-[methyl-[6-methyl-2-(2,3,4-trimethoxyphenyl)quinoline-4-carbothioyl]amino]acetic acid CAS Name: 2-[methyl-[[6-methyl-2-(2,3,4-trimethoxyphenyl)-4-quinolinyl]-sulfanylidenemethyl]amino]acetic acid IUPAC Name: 2-[methyl-[6-methyl-2-(2,3,4-trimethoxyphenyl)quinoline-4-carbothioyl]amino]acetic acid Traditional Name: 2-[methyl-[6-methyl-2-(2,3,4-trimethoxyphenyl)quinoline-4-carbothioyl]amino]acetic acid Formula: C23H24N2O5S MolecularWeight: 440.51206

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC2=C(C=C1)N=C(C=C2C(=S)N(C)CC(=O)O)C3=C(C(=C(C=C3)OC)OC)OC

Isomeric SMILES

CC1=CC2=C(C=C1)N=C(C=C2C(=S)N(C)CC(=O)O)C3=C(C(=C(C=C3)OC)OC)OC

InChI

InChI=1S/C23H24N2O5S/c1-13-6-8-17-15(10-13)16(23(31)25(2)12-20(26)27)11-18(24-17)14-7-9-19(28-3)22(30-5)21(14)29-4/h6-11H,12H2,1-5H3,(H,26,27)