S-[[6-(2-methoxyphenyl)-2,2-dimethyl-1H-quinolin-4-yl]methyl] ethanethioate

Systemtic Name: S-[[6-(2-methoxyphenyl)-2,2-dimethyl-1H-quinolin-4-yl]methyl] ethanethioate Openeye Name: S-[[6-(2-methoxyphenyl)-2,2-dimethyl-1H-quinolin-4-yl]methyl] ethanethioate CAS Name: ethanethioic acid S-[[6-(2-methoxyphenyl)-2,2-dimethyl-1H-quinolin-4-yl]methyl] ester IUPAC Name: S-[[6-(2-methoxyphenyl)-2,2-dimethyl-1H-quinolin-4-yl]methyl] ethanethioate Traditional Name: ethanethioic acid S-[[6-(2-methoxyphenyl)-2,2-dimethyl-1H-quinolin-4-yl]methyl] ester Formula: C21H23NO2S MolecularWeight: 353.47782

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)SCC1=CC(NC2=C1C=C(C=C2)C3=CC=CC=C3OC)(C)C

Isomeric SMILES

CC(=O)SCC1=CC(NC2=C1C=C(C=C2)C3=CC=CC=C3OC)(C)C

InChI

InChI=1S/C21H23NO2S/c1-14(23)25-13-16-12-21(2,3)22-19-10-9-15(11-18(16)19)17-7-5-6-8-20(17)24-4/h5-12,22H,13H2,1-4H3