N-(2,3-dimethylcyclohexyl)-6-morpholin-4-ylsulfonyl-2-pyridin-2-yl-quinoline-4-carboxamide

Systemtic Name: N-(2,3-dimethylcyclohexyl)-6-morpholin-4-ylsulfonyl-2-pyridin-2-yl-quinoline-4-carboxamide Openeye Name: N-(2,3-dimethylcyclohexyl)-6-morpholinosulfonyl-2-(2-pyridyl)quinoline-4-carboxamide CAS Name: N-(2,3-dimethylcyclohexyl)-6-(4-morpholinylsulfonyl)-2-(2-pyridinyl)-4-quinolinecarboxamide IUPAC Name: N-(2,3-dimethylcyclohexyl)-6-morpholin-4-ylsulfonyl-2-pyridin-2-ylquinoline-4-carboxamide Traditional Name: N-(2,3-dimethylcyclohexyl)-6-morpholinosulfonyl-2-(2-pyridyl)cinchoninamide Formula: C27H32N4O4S MolecularWeight: 508.63238

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCCC(C1C)NC(=O)C2=CC(=NC3=C2C=C(C=C3)S(=O)(=O)N4CCOCC4)C5=CC=CC=N5

Isomeric SMILES

CC1CCCC(C1C)NC(=O)C2=CC(=NC3=C2C=C(C=C3)S(=O)(=O)N4CCOCC4)C5=CC=CC=N5

InChI

InChI=1S/C27H32N4O4S/c1-18-6-5-8-23(19(18)2)30-27(32)22-17-26(25-7-3-4-11-28-25)29-24-10-9-20(16-21(22)24)36(33,34)31-12-14-35-15-13-31/h3-4,7,9-11,16-19,23H,5-6,8,12-15H2,1-2H3,(H,30,32)