[2-azanyl-6-[(1-methylsulfonylpiperidin-4-yl)amino]pyridin-3-yl]-(4-chloranyl-5-fluoranyl-2-methoxy-phenyl)methanone

Systemtic Name: [2-azanyl-6-[(1-methylsulfonylpiperidin-4-yl)amino]pyridin-3-yl]-(4-chloranyl-5-fluoranyl-2-methoxy-phenyl)methanone Openeye Name: [2-amino-6-[(1-methylsulfonyl-4-piperidyl)amino]-3-pyridyl]-(4-chloro-5-fluoro-2-methoxy-phenyl)methanone CAS Name: [2-amino-6-[(1-methylsulfonyl-4-piperidinyl)amino]-3-pyridinyl]-(4-chloro-5-fluoro-2-methoxyphenyl)methanone IUPAC Name: [2-amino-6-[(1-methylsulfonylpiperidin-4-yl)amino]pyridin-3-yl]-(4-chloro-5-fluoro-2-methoxyphenyl)methanone Traditional Name: [2-amino-6-[(1-mesyl-4-piperidyl)amino]-3-pyridyl]-(4-chloro-5-fluoro-2-methoxy-phenyl)methanone Formula: C19H22ClFN4O4S MolecularWeight: 456.918783

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=C(C=C1C(=O)C2=C(N=C(C=C2)NC3CCN(CC3)S(=O)(=O)C)N)F)Cl

Isomeric SMILES

COC1=CC(=C(C=C1C(=O)C2=C(N=C(C=C2)NC3CCN(CC3)S(=O)(=O)C)N)F)Cl

InChI

InChI=1S/C19H22ClFN4O4S/c1-29-16-10-14(20)15(21)9-13(16)18(26)12-3-4-17(24-19(12)22)23-11-5-7-25(8-6-11)30(2,27)28/h3-4,9-11H,5-8H2,1-2H3,(H3,22,23,24)