N-[1-(4-methylsulfonylphenyl)ethyl]-2-phenyl-quinoline-4-carboxamide

Systemtic Name: N-[1-(4-methylsulfonylphenyl)ethyl]-2-phenyl-quinoline-4-carboxamide Openeye Name: N-[1-(4-methylsulfonylphenyl)ethyl]-2-phenyl-quinoline-4-carboxamide CAS Name: N-[1-(4-methylsulfonylphenyl)ethyl]-2-phenyl-4-quinolinecarboxamide IUPAC Name: N-[1-(4-methylsulfonylphenyl)ethyl]-2-phenylquinoline-4-carboxamide Traditional Name: N-[1-(4-mesylphenyl)ethyl]-2-phenyl-cinchoninamide Formula: C25H22N2O3S MolecularWeight: 430.51878

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Descriptors Computed from Structure

Canonical SMILES:

CC(C1=CC=C(C=C1)S(=O)(=O)C)NC(=O)C2=CC(=NC3=CC=CC=C32)C4=CC=CC=C4

Isomeric SMILES

CC(C1=CC=C(C=C1)S(=O)(=O)C)NC(=O)C2=CC(=NC3=CC=CC=C32)C4=CC=CC=C4

InChI

InChI=1S/C25H22N2O3S/c1-17(18-12-14-20(15-13-18)31(2,29)30)26-25(28)22-16-24(19-8-4-3-5-9-19)27-23-11-7-6-10-21(22)23/h3-17H,1-2H3,(H,26,28)