10b-methyl-8-(2-methylphenyl)sulfanyl-1,2,4,4a,5,6-hexahydrobenzo[f]quinolin-3-one

Systemtic Name: 10b-methyl-8-(2-methylphenyl)sulfanyl-1,2,4,4a,5,6-hexahydrobenzo[f]quinolin-3-one Openeye Name: 10b-methyl-8-(o-tolylsulfanyl)-1,2,4,4a,5,6-hexahydrobenzo[f]quinolin-3-one CAS Name: 10b-methyl-8-[(2-methylphenyl)thio]-1,2,4,4a,5,6-hexahydrobenzo[f]quinolin-3-one IUPAC Name: 10b-methyl-8-(2-methylphenyl)sulfanyl-1,2,4,4a,5,6-hexahydrobenzo[f]quinolin-3-one Traditional Name: 10b-methyl-8-(o-tolylthio)-1,2,4,4a,5,6-hexahydrobenzo[f]quinolin-3-one Formula: C21H23NOS MolecularWeight: 337.47842

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1SC2=CC3=C(C=C2)C4(CCC(=O)NC4CC3)C

Isomeric SMILES

CC1=CC=CC=C1SC2=CC3=C(C=C2)C4(CCC(=O)NC4CC3)C

InChI

InChI=1S/C21H23NOS/c1-14-5-3-4-6-18(14)24-16-8-9-17-15(13-16)7-10-19-21(17,2)12-11-20(23)22-19/h3-6,8-9,13,19H,7,10-12H2,1-2H3,(H,22,23)