N-(3-aminocarbonyl-5-propan-2-yl-thiophen-2-yl)-6-bromanyl-2-(3-methylphenyl)quinoline-4-carboxamide

Systemtic Name: N-(3-aminocarbonyl-5-propan-2-yl-thiophen-2-yl)-6-bromanyl-2-(3-methylphenyl)quinoline-4-carboxamide Openeye Name: 6-bromo-N-(3-carbamoyl-5-isopropyl-2-thienyl)-2-(m-tolyl)quinoline-4-carboxamide CAS Name: 6-bromo-N-(3-carbamoyl-5-propan-2-yl-2-thiophenyl)-2-(3-methylphenyl)-4-quinolinecarboxamide IUPAC Name: 6-bromo-N-(3-carbamoyl-5-propan-2-ylthiophen-2-yl)-2-(3-methylphenyl)quinoline-4-carboxamide Traditional Name: 6-bromo-N-(3-carbamoyl-5-isopropyl-2-thienyl)-2-(m-tolyl)cinchoninamide Formula: C25H22BrN3O2S MolecularWeight: 508.43008

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC(=C1)C2=NC3=C(C=C(C=C3)Br)C(=C2)C(=O)NC4=C(C=C(S4)C(C)C)C(=O)N

Isomeric SMILES

CC1=CC=CC(=C1)C2=NC3=C(C=C(C=C3)Br)C(=C2)C(=O)NC4=C(C=C(S4)C(C)C)C(=O)N

InChI

InChI=1S/C25H22BrN3O2S/c1-13(2)22-12-19(23(27)30)25(32-22)29-24(31)18-11-21(15-6-4-5-14(3)9-15)28-20-8-7-16(26)10-17(18)20/h4-13H,1-3H3,(H2,27,30)(H,29,31)