N-methyl-N-[(4-methylsulfanylphenyl)methyl]-1-methylsulfonyl-3,4-dihydro-2H-quinoline-6-carboxamide

Systemtic Name: N-methyl-N-[(4-methylsulfanylphenyl)methyl]-1-methylsulfonyl-3,4-dihydro-2H-quinoline-6-carboxamide Openeye Name: N-methyl-N-[(4-methylsulfanylphenyl)methyl]-1-methylsulfonyl-3,4-dihydro-2H-quinoline-6-carboxamide CAS Name: N-methyl-1-methylsulfonyl-N-[[4-(methylthio)phenyl]methyl]-3,4-dihydro-2H-quinoline-6-carboxamide IUPAC Name: N-methyl-N-[(4-methylsulfanylphenyl)methyl]-1-methylsulfonyl-3,4-dihydro-2H-quinoline-6-carboxamide Traditional Name: 1-mesyl-N-methyl-N-[4-(methylthio)benzyl]-3,4-dihydro-2H-quinoline-6-carboxamide Formula: C20H24N2O3S2 MolecularWeight: 404.54616

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Descriptors Computed from Structure

Canonical SMILES:

CN(CC1=CC=C(C=C1)SC)C(=O)C2=CC3=C(C=C2)N(CCC3)S(=O)(=O)C

Isomeric SMILES

CN(CC1=CC=C(C=C1)SC)C(=O)C2=CC3=C(C=C2)N(CCC3)S(=O)(=O)C

InChI

InChI=1S/C20H24N2O3S2/c1-21(14-15-6-9-18(26-2)10-7-15)20(23)17-8-11-19-16(13-17)5-4-12-22(19)27(3,24)25/h6-11,13H,4-5,12,14H2,1-3H3