methyl 7-(4-methylphenyl)-9-methylsulfanyl-6H-benzo[c]thiochromene-10-carboxylate

Systemtic Name: methyl 7-(4-methylphenyl)-9-methylsulfanyl-6H-benzo[c]thiochromene-10-carboxylate Openeye Name: methyl 9-methylsulfanyl-7-(p-tolyl)-6H-benzo[c]thiochromene-10-carboxylate CAS Name: 7-(4-methylphenyl)-9-(methylthio)-6H-benzo[c]thiochromene-10-carboxylic acid methyl ester IUPAC Name: methyl 7-(4-methylphenyl)-9-methylsulfanyl-6H-benzo[c]thiochromene-10-carboxylate Traditional Name: 9-(methylthio)-7-(p-tolyl)-6H-benzo[c]thiochromene-10-carboxylic acid methyl ester Formula: C23H20O2S2 MolecularWeight: 392.5337

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C2=CC(=C(C3=C2CSC4=CC=CC=C43)C(=O)OC)SC

Isomeric SMILES

CC1=CC=C(C=C1)C2=CC(=C(C3=C2CSC4=CC=CC=C43)C(=O)OC)SC

InChI

InChI=1S/C23H20O2S2/c1-14-8-10-15(11-9-14)17-12-20(26-3)22(23(24)25-2)21-16-6-4-5-7-19(16)27-13-18(17)21/h4-12H,13H2,1-3H3