6-tert-butylsulfonyl-4-[(5-fluoranylpyridin-3-yl)amino]-8-methyl-quinoline-3-carboxamide

Systemtic Name: 6-tert-butylsulfonyl-4-[(5-fluoranylpyridin-3-yl)amino]-8-methyl-quinoline-3-carboxamide Openeye Name: 6-tert-butylsulfonyl-4-[(5-fluoro-3-pyridyl)amino]-8-methyl-quinoline-3-carboxamide CAS Name: 6-tert-butylsulfonyl-4-[(5-fluoro-3-pyridinyl)amino]-8-methyl-3-quinolinecarboxamide IUPAC Name: 6-tert-butylsulfonyl-4-[(5-fluoropyridin-3-yl)amino]-8-methylquinoline-3-carboxamide Traditional Name: 6-tert-butylsulfonyl-4-[(5-fluoro-3-pyridyl)amino]-8-methyl-quinoline-3-carboxamide Formula: C20H21FN4O3S MolecularWeight: 416.469143

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C2C(=CC(=C1)S(=O)(=O)C(C)(C)C)C(=C(C=N2)C(=O)N)NC3=CC(=CN=C3)F

Isomeric SMILES

CC1=C2C(=CC(=C1)S(=O)(=O)C(C)(C)C)C(=C(C=N2)C(=O)N)NC3=CC(=CN=C3)F

InChI

InChI=1S/C20H21FN4O3S/c1-11-5-14(29(27,28)20(2,3)4)7-15-17(11)24-10-16(19(22)26)18(15)25-13-6-12(21)8-23-9-13/h5-10H,1-4H3,(H2,22,26)(H,24,25)