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

Systemtic Name: N-methyl-N-[[4-(methylcarbamoyl)phenyl]methyl]-1-methylsulfonyl-3,4-dihydro-2H-quinoline-6-carboxamide Openeye Name: N-methyl-N-[[4-(methylcarbamoyl)phenyl]methyl]-1-methylsulfonyl-3,4-dihydro-2H-quinoline-6-carboxamide CAS Name: N-methyl-N-[[4-(methylcarbamoyl)phenyl]methyl]-1-methylsulfonyl-3,4-dihydro-2H-quinoline-6-carboxamide IUPAC Name: N-methyl-N-[[4-(methylcarbamoyl)phenyl]methyl]-1-methylsulfonyl-3,4-dihydro-2H-quinoline-6-carboxamide Traditional Name: 1-mesyl-N-methyl-N-[4-(methylcarbamoyl)benzyl]-3,4-dihydro-2H-quinoline-6-carboxamide Formula: C21H25N3O4S MolecularWeight: 415.5059

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C21H25N3O4S/c1-22-20(25)16-8-6-15(7-9-16)14-23(2)21(26)18-10-11-19-17(13-18)5-4-12-24(19)29(3,27)28/h6-11,13H,4-5,12,14H2,1-3H3,(H,22,25)