N-[cyclopropyl-(3-fluorophenyl)methyl]-3-methylsulfonyl-2-phenyl-quinoline-4-carboxamide

Systemtic Name: N-[cyclopropyl-(3-fluorophenyl)methyl]-3-methylsulfonyl-2-phenyl-quinoline-4-carboxamide Openeye Name: N-[cyclopropyl-(3-fluorophenyl)methyl]-3-methylsulfonyl-2-phenyl-quinoline-4-carboxamide CAS Name: N-[cyclopropyl-(3-fluorophenyl)methyl]-3-methylsulfonyl-2-phenyl-4-quinolinecarboxamide IUPAC Name: N-[cyclopropyl-(3-fluorophenyl)methyl]-3-methylsulfonyl-2-phenylquinoline-4-carboxamide Traditional Name: N-[cyclopropyl-(3-fluorophenyl)methyl]-3-mesyl-2-phenyl-cinchoninamide Formula: C27H23FN2O3S MolecularWeight: 474.546523

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Descriptors Computed from Structure

Canonical SMILES:

CS(=O)(=O)C1=C(C2=CC=CC=C2N=C1C3=CC=CC=C3)C(=O)NC(C4CC4)C5=CC(=CC=C5)F

Isomeric SMILES

CS(=O)(=O)C1=C(C2=CC=CC=C2N=C1C3=CC=CC=C3)C(=O)NC(C4CC4)C5=CC(=CC=C5)F

InChI

InChI=1S/C27H23FN2O3S/c1-34(32,33)26-23(27(31)30-24(18-14-15-18)19-10-7-11-20(28)16-19)21-12-5-6-13-22(21)29-25(26)17-8-3-2-4-9-17/h2-13,16,18,24H,14-15H2,1H3,(H,30,31)