N-[4,5-dimethyl-3-(pyridin-3-ylmethylcarbamoyl)thiophen-2-yl]-2-phenyl-quinoline-4-carboxamide

Systemtic Name: N-[4,5-dimethyl-3-(pyridin-3-ylmethylcarbamoyl)thiophen-2-yl]-2-phenyl-quinoline-4-carboxamide Openeye Name: N-[4,5-dimethyl-3-(3-pyridylmethylcarbamoyl)-2-thienyl]-2-phenyl-quinoline-4-carboxamide CAS Name: N-[4,5-dimethyl-3-[oxo-(3-pyridinylmethylamino)methyl]-2-thiophenyl]-2-phenyl-4-quinolinecarboxamide IUPAC Name: N-[4,5-dimethyl-3-(pyridin-3-ylmethylcarbamoyl)thiophen-2-yl]-2-phenylquinoline-4-carboxamide Traditional Name: N-[4,5-dimethyl-3-(3-pyridylmethylcarbamoyl)-2-thienyl]-2-phenyl-cinchoninamide Formula: C29H24N4O2S MolecularWeight: 492.59146

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(SC(=C1C(=O)NCC2=CN=CC=C2)NC(=O)C3=CC(=NC4=CC=CC=C43)C5=CC=CC=C5)C

Isomeric SMILES

CC1=C(SC(=C1C(=O)NCC2=CN=CC=C2)NC(=O)C3=CC(=NC4=CC=CC=C43)C5=CC=CC=C5)C

InChI

InChI=1S/C29H24N4O2S/c1-18-19(2)36-29(26(18)28(35)31-17-20-9-8-14-30-16-20)33-27(34)23-15-25(21-10-4-3-5-11-21)32-24-13-7-6-12-22(23)24/h3-16H,17H2,1-2H3,(H,31,35)(H,33,34)