6-bromanyl-N-(3-morpholin-4-ylcarbonyl-5-propan-2-yl-thiophen-2-yl)-2-pyridin-3-yl-quinoline-4-carboxamide

Systemtic Name: 6-bromanyl-N-(3-morpholin-4-ylcarbonyl-5-propan-2-yl-thiophen-2-yl)-2-pyridin-3-yl-quinoline-4-carboxamide Openeye Name: 6-bromo-N-[5-isopropyl-3-(morpholine-4-carbonyl)-2-thienyl]-2-(3-pyridyl)quinoline-4-carboxamide CAS Name: 6-bromo-N-[3-[4-morpholinyl(oxo)methyl]-5-propan-2-yl-2-thiophenyl]-2-(3-pyridinyl)-4-quinolinecarboxamide IUPAC Name: 6-bromo-N-[3-(morpholine-4-carbonyl)-5-propan-2-ylthiophen-2-yl]-2-pyridin-3-ylquinoline-4-carboxamide Traditional Name: 6-bromo-N-[5-isopropyl-3-(morpholine-4-carbonyl)-2-thienyl]-2-(3-pyridyl)cinchoninamide Formula: C27H25BrN4O3S MolecularWeight: 565.4814

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C1=CC(=C(S1)NC(=O)C2=CC(=NC3=C2C=C(C=C3)Br)C4=CN=CC=C4)C(=O)N5CCOCC5

Isomeric SMILES

CC(C)C1=CC(=C(S1)NC(=O)C2=CC(=NC3=C2C=C(C=C3)Br)C4=CN=CC=C4)C(=O)N5CCOCC5

InChI

InChI=1S/C27H25BrN4O3S/c1-16(2)24-14-21(27(34)32-8-10-35-11-9-32)26(36-24)31-25(33)20-13-23(17-4-3-7-29-15-17)30-22-6-5-18(28)12-19(20)22/h3-7,12-16H,8-11H2,1-2H3,(H,31,33)