N-[3-(diethylamino)propyl]-6-morpholin-4-ylsulfonyl-2-pyridin-4-yl-quinoline-4-carboxamide

Systemtic Name: N-[3-(diethylamino)propyl]-6-morpholin-4-ylsulfonyl-2-pyridin-4-yl-quinoline-4-carboxamide Openeye Name: N-[3-(diethylamino)propyl]-6-morpholinosulfonyl-2-(4-pyridyl)quinoline-4-carboxamide CAS Name: N-[3-(diethylamino)propyl]-6-(4-morpholinylsulfonyl)-2-pyridin-4-yl-4-quinolinecarboxamide IUPAC Name: N-[3-(diethylamino)propyl]-6-morpholin-4-ylsulfonyl-2-pyridin-4-ylquinoline-4-carboxamide Traditional Name: N-[3-(diethylamino)propyl]-6-morpholinosulfonyl-2-(4-pyridyl)cinchoninamide Formula: C26H33N5O4S MolecularWeight: 511.63632

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)CCCNC(=O)C1=CC(=NC2=C1C=C(C=C2)S(=O)(=O)N3CCOCC3)C4=CC=NC=C4

Isomeric SMILES

CCN(CC)CCCNC(=O)C1=CC(=NC2=C1C=C(C=C2)S(=O)(=O)N3CCOCC3)C4=CC=NC=C4

InChI

InChI=1S/C26H33N5O4S/c1-3-30(4-2)13-5-10-28-26(32)23-19-25(20-8-11-27-12-9-20)29-24-7-6-21(18-22(23)24)36(33,34)31-14-16-35-17-15-31/h6-9,11-12,18-19H,3-5,10,13-17H2,1-2H3,(H,28,32)