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

Systemtic Name: N-[cyclopropyl(phenyl)methyl]-3-(methylsulfinylmethyl)-2-phenyl-quinoline-4-carboxamide Openeye Name: N-[cyclopropyl(phenyl)methyl]-3-(methylsulfinylmethyl)-2-phenyl-quinoline-4-carboxamide CAS Name: N-[cyclopropyl(phenyl)methyl]-3-(methylsulfinylmethyl)-2-phenyl-4-quinolinecarboxamide IUPAC Name: N-[cyclopropyl(phenyl)methyl]-3-(methylsulfinylmethyl)-2-phenylquinoline-4-carboxamide Traditional Name: N-[cyclopropyl(phenyl)methyl]-3-(methylsulfinylmethyl)-2-phenyl-cinchoninamide Formula: C28H26N2O2S MolecularWeight: 454.58324

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Descriptors Computed from Structure

Canonical SMILES:

CS(=O)CC1=C(C2=CC=CC=C2N=C1C3=CC=CC=C3)C(=O)NC(C4CC4)C5=CC=CC=C5

Isomeric SMILES

CS(=O)CC1=C(C2=CC=CC=C2N=C1C3=CC=CC=C3)C(=O)NC(C4CC4)C5=CC=CC=C5

InChI

InChI=1S/C28H26N2O2S/c1-33(32)18-23-25(28(31)30-26(21-16-17-21)19-10-4-2-5-11-19)22-14-8-9-15-24(22)29-27(23)20-12-6-3-7-13-20/h2-15,21,26H,16-18H2,1H3,(H,30,31)