N-[(4-methylphenyl)methyl]-6-morpholin-4-ylsulfonyl-2-pyridin-4-yl-quinoline-4-carboxamide

Systemtic Name: N-[(4-methylphenyl)methyl]-6-morpholin-4-ylsulfonyl-2-pyridin-4-yl-quinoline-4-carboxamide Openeye Name: 6-morpholinosulfonyl-N-(p-tolylmethyl)-2-(4-pyridyl)quinoline-4-carboxamide CAS Name: N-[(4-methylphenyl)methyl]-6-(4-morpholinylsulfonyl)-2-pyridin-4-yl-4-quinolinecarboxamide IUPAC Name: N-[(4-methylphenyl)methyl]-6-morpholin-4-ylsulfonyl-2-pyridin-4-ylquinoline-4-carboxamide Traditional Name: N-(4-methylbenzyl)-6-morpholinosulfonyl-2-(4-pyridyl)cinchoninamide Formula: C27H26N4O4S MolecularWeight: 502.58474

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)CNC(=O)C2=CC(=NC3=C2C=C(C=C3)S(=O)(=O)N4CCOCC4)C5=CC=NC=C5

Isomeric SMILES

CC1=CC=C(C=C1)CNC(=O)C2=CC(=NC3=C2C=C(C=C3)S(=O)(=O)N4CCOCC4)C5=CC=NC=C5

InChI

InChI=1S/C27H26N4O4S/c1-19-2-4-20(5-3-19)18-29-27(32)24-17-26(21-8-10-28-11-9-21)30-25-7-6-22(16-23(24)25)36(33,34)31-12-14-35-15-13-31/h2-11,16-17H,12-15,18H2,1H3,(H,29,32)