6-methylsulfonyl-4-(oxan-4-ylamino)quinoline-3-carboxamide

Systemtic Name: 6-methylsulfonyl-4-(oxan-4-ylamino)quinoline-3-carboxamide Openeye Name: 6-methylsulfonyl-4-(tetrahydropyran-4-ylamino)quinoline-3-carboxamide CAS Name: 6-methylsulfonyl-4-(4-oxanylamino)-3-quinolinecarboxamide IUPAC Name: 6-methylsulfonyl-4-(oxan-4-ylamino)quinoline-3-carboxamide Traditional Name: 6-mesyl-4-(tetrahydropyran-4-ylamino)quinoline-3-carboxamide Formula: C16H19N3O4S MolecularWeight: 349.40476

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CS(=O)(=O)C1=CC2=C(C(=CN=C2C=C1)C(=O)N)NC3CCOCC3

Isomeric SMILES

CS(=O)(=O)C1=CC2=C(C(=CN=C2C=C1)C(=O)N)NC3CCOCC3

InChI

InChI=1S/C16H19N3O4S/c1-24(21,22)11-2-3-14-12(8-11)15(13(9-18-14)16(17)20)19-10-4-6-23-7-5-10/h2-3,8-10H,4-7H2,1H3,(H2,17,20)(H,18,19)