propan-2-yl 4-[(4,8-dimethylquinolin-2-yl)sulfanylmethyl]benzoate

Systemtic Name: propan-2-yl 4-[(4,8-dimethylquinolin-2-yl)sulfanylmethyl]benzoate Openeye Name: isopropyl 4-[(4,8-dimethyl-2-quinolyl)sulfanylmethyl]benzoate CAS Name: 4-[[(4,8-dimethyl-2-quinolinyl)thio]methyl]benzoic acid propan-2-yl ester IUPAC Name: propan-2-yl 4-[(4,8-dimethylquinolin-2-yl)sulfanylmethyl]benzoate Traditional Name: 4-[[(4,8-dimethyl-2-quinolyl)thio]methyl]benzoic acid isopropyl ester Formula: C22H23NO2S MolecularWeight: 365.48852

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC2=C1N=C(C=C2C)SCC3=CC=C(C=C3)C(=O)OC(C)C

Isomeric SMILES

CC1=CC=CC2=C1N=C(C=C2C)SCC3=CC=C(C=C3)C(=O)OC(C)C

InChI

InChI=1S/C22H23NO2S/c1-14(2)25-22(24)18-10-8-17(9-11-18)13-26-20-12-16(4)19-7-5-6-15(3)21(19)23-20/h5-12,14H,13H2,1-4H3