6-bromanyl-8-methyl-N-(phenylmethyl)-2-thiophen-2-yl-quinoline-4-carboxamide

Systemtic Name: 6-bromanyl-8-methyl-N-(phenylmethyl)-2-thiophen-2-yl-quinoline-4-carboxamide Openeye Name: N-benzyl-6-bromo-8-methyl-2-(2-thienyl)quinoline-4-carboxamide CAS Name: 6-bromo-8-methyl-N-(phenylmethyl)-2-thiophen-2-yl-4-quinolinecarboxamide IUPAC Name: N-benzyl-6-bromo-8-methyl-2-thiophen-2-ylquinoline-4-carboxamide Traditional Name: N-benzyl-6-bromo-8-methyl-2-(2-thienyl)cinchoninamide Formula: C22H17BrN2OS MolecularWeight: 437.35218

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C2C(=CC(=C1)Br)C(=CC(=N2)C3=CC=CS3)C(=O)NCC4=CC=CC=C4

Isomeric SMILES

CC1=C2C(=CC(=C1)Br)C(=CC(=N2)C3=CC=CS3)C(=O)NCC4=CC=CC=C4

InChI

InChI=1S/C22H17BrN2OS/c1-14-10-16(23)11-17-18(22(26)24-13-15-6-3-2-4-7-15)12-19(25-21(14)17)20-8-5-9-27-20/h2-12H,13H2,1H3,(H,24,26)