N-[4-(3,5-dimethylpiperidin-1-yl)sulfonylphenyl]-2-(4-methoxyphenyl)quinoline-4-carboxamide

Systemtic Name: N-[4-(3,5-dimethylpiperidin-1-yl)sulfonylphenyl]-2-(4-methoxyphenyl)quinoline-4-carboxamide Openeye Name: N-[4-[(3,5-dimethyl-1-piperidyl)sulfonyl]phenyl]-2-(4-methoxyphenyl)quinoline-4-carboxamide CAS Name: N-[4-[(3,5-dimethyl-1-piperidinyl)sulfonyl]phenyl]-2-(4-methoxyphenyl)-4-quinolinecarboxamide IUPAC Name: N-[4-(3,5-dimethylpiperidin-1-yl)sulfonylphenyl]-2-(4-methoxyphenyl)quinoline-4-carboxamide Traditional Name: N-[4-(3,5-dimethylpiperidino)sulfonylphenyl]-2-(4-methoxyphenyl)cinchoninamide Formula: C30H31N3O4S MolecularWeight: 529.64984

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Descriptors Computed from Structure

Canonical SMILES:

CC1CC(CN(C1)S(=O)(=O)C2=CC=C(C=C2)NC(=O)C3=CC(=NC4=CC=CC=C43)C5=CC=C(C=C5)OC)C

Isomeric SMILES

CC1CC(CN(C1)S(=O)(=O)C2=CC=C(C=C2)NC(=O)C3=CC(=NC4=CC=CC=C43)C5=CC=C(C=C5)OC)C

InChI

InChI=1S/C30H31N3O4S/c1-20-16-21(2)19-33(18-20)38(35,36)25-14-10-23(11-15-25)31-30(34)27-17-29(22-8-12-24(37-3)13-9-22)32-28-7-5-4-6-26(27)28/h4-15,17,20-21H,16,18-19H2,1-3H3,(H,31,34)