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

Systemtic Name: N-[2-[[cyclohexyl(methyl)amino]methyl]phenyl]-1-methylsulfonyl-3,4-dihydro-2H-quinoline-6-carboxamide Openeye Name: N-[2-[[cyclohexyl(methyl)amino]methyl]phenyl]-1-methylsulfonyl-3,4-dihydro-2H-quinoline-6-carboxamide CAS Name: N-[2-[[cyclohexyl(methyl)amino]methyl]phenyl]-1-methylsulfonyl-3,4-dihydro-2H-quinoline-6-carboxamide IUPAC Name: N-[2-[[cyclohexyl(methyl)amino]methyl]phenyl]-1-methylsulfonyl-3,4-dihydro-2H-quinoline-6-carboxamide Traditional Name: N-[2-[[cyclohexyl(methyl)amino]methyl]phenyl]-1-mesyl-3,4-dihydro-2H-quinoline-6-carboxamide Formula: C25H33N3O3S MolecularWeight: 455.61282

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Descriptors Computed from Structure

Canonical SMILES:

CN(CC1=CC=CC=C1NC(=O)C2=CC3=C(C=C2)N(CCC3)S(=O)(=O)C)C4CCCCC4

Isomeric SMILES

CN(CC1=CC=CC=C1NC(=O)C2=CC3=C(C=C2)N(CCC3)S(=O)(=O)C)C4CCCCC4

InChI

InChI=1S/C25H33N3O3S/c1-27(22-11-4-3-5-12-22)18-21-9-6-7-13-23(21)26-25(29)20-14-15-24-19(17-20)10-8-16-28(24)32(2,30)31/h6-7,9,13-15,17,22H,3-5,8,10-12,16,18H2,1-2H3,(H,26,29)