4-[(3-cyanophenyl)amino]-8-methyl-6-morpholin-4-ylsulfonyl-quinoline-3-carboxamide

Systemtic Name: 4-[(3-cyanophenyl)amino]-8-methyl-6-morpholin-4-ylsulfonyl-quinoline-3-carboxamide Openeye Name: 4-(3-cyanoanilino)-8-methyl-6-morpholinosulfonyl-quinoline-3-carboxamide CAS Name: 4-(3-cyanoanilino)-8-methyl-6-(4-morpholinylsulfonyl)-3-quinolinecarboxamide IUPAC Name: 4-(3-cyanoanilino)-8-methyl-6-morpholin-4-ylsulfonylquinoline-3-carboxamide Traditional Name: 4-(3-cyanoanilino)-8-methyl-6-morpholinosulfonyl-quinoline-3-carboxamide Formula: C22H21N5O4S MolecularWeight: 451.49824

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C2C(=CC(=C1)S(=O)(=O)N3CCOCC3)C(=C(C=N2)C(=O)N)NC4=CC=CC(=C4)C#N

Isomeric SMILES

CC1=C2C(=CC(=C1)S(=O)(=O)N3CCOCC3)C(=C(C=N2)C(=O)N)NC4=CC=CC(=C4)C#N

InChI

InChI=1S/C22H21N5O4S/c1-14-9-17(32(29,30)27-5-7-31-8-6-27)11-18-20(14)25-13-19(22(24)28)21(18)26-16-4-2-3-15(10-16)12-23/h2-4,9-11,13H,5-8H2,1H3,(H2,24,28)(H,25,26)