N-[4-azanyl-5-[2,3-bis(fluoranyl)-6-methoxy-5-oxidanyl-phenyl]carbonyl-pyrimidin-2-yl]-N-piperidin-4-yl-methanesulfonamide

Systemtic Name: N-[4-azanyl-5-[2,3-bis(fluoranyl)-6-methoxy-5-oxidanyl-phenyl]carbonyl-pyrimidin-2-yl]-N-piperidin-4-yl-methanesulfonamide Openeye Name: N-[4-amino-5-(2,3-difluoro-5-hydroxy-6-methoxy-benzoyl)pyrimidin-2-yl]-N-(4-piperidyl)methanesulfonamide CAS Name: N-[4-amino-5-[(2,3-difluoro-5-hydroxy-6-methoxyphenyl)-oxomethyl]-2-pyrimidinyl]-N-(4-piperidinyl)methanesulfonamide IUPAC Name: N-[4-amino-5-(2,3-difluoro-5-hydroxy-6-methoxybenzoyl)pyrimidin-2-yl]-N-piperidin-4-ylmethanesulfonamide Traditional Name: N-[4-amino-5-(2,3-difluoro-5-hydroxy-6-methoxy-benzoyl)pyrimidin-2-yl]-N-(4-piperidyl)methanesulfonamide Formula: C18H21F2N5O5S MolecularWeight: 457.451646

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C(=C(C=C1O)F)F)C(=O)C2=CN=C(N=C2N)N(C3CCNCC3)S(=O)(=O)C

Isomeric SMILES

COC1=C(C(=C(C=C1O)F)F)C(=O)C2=CN=C(N=C2N)N(C3CCNCC3)S(=O)(=O)C

InChI

InChI=1S/C18H21F2N5O5S/c1-30-16-12(26)7-11(19)14(20)13(16)15(27)10-8-23-18(24-17(10)21)25(31(2,28)29)9-3-5-22-6-4-9/h7-9,22,26H,3-6H2,1-2H3,(H2,21,23,24)