[1-[(4-ethylphenyl)amino]-1-oxidanylidene-propan-2-yl] 2-(4-methylquinolin-2-yl)sulfanylethanoate

Systemtic Name: [1-[(4-ethylphenyl)amino]-1-oxidanylidene-propan-2-yl] 2-(4-methylquinolin-2-yl)sulfanylethanoate Openeye Name: [2-(4-ethylanilino)-1-methyl-2-oxo-ethyl] 2-[(4-methyl-2-quinolyl)sulfanyl]acetate CAS Name: 2-[(4-methyl-2-quinolinyl)thio]acetic acid [1-(4-ethylanilino)-1-oxopropan-2-yl] ester IUPAC Name: [1-(4-ethylanilino)-1-oxopropan-2-yl] 2-(4-methylquinolin-2-yl)sulfanylacetate Traditional Name: 2-[(4-methyl-2-quinolyl)thio]acetic acid [2-(4-ethylanilino)-2-keto-1-methyl-ethyl] ester Formula: C23H24N2O3S MolecularWeight: 408.51326

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC=C(C=C1)NC(=O)C(C)OC(=O)CSC2=NC3=CC=CC=C3C(=C2)C

Isomeric SMILES

CCC1=CC=C(C=C1)NC(=O)C(C)OC(=O)CSC2=NC3=CC=CC=C3C(=C2)C

InChI

InChI=1S/C23H24N2O3S/c1-4-17-9-11-18(12-10-17)24-23(27)16(3)28-22(26)14-29-21-13-15(2)19-7-5-6-8-20(19)25-21/h5-13,16H,4,14H2,1-3H3,(H,24,27)