N-[4-azanyl-5-(5-fluoranyl-2-methoxy-phenyl)carbonyl-pyrimidin-2-yl]-N-pyrrolidin-3-yl-methanesulfonamide

Systemtic Name: N-[4-azanyl-5-(5-fluoranyl-2-methoxy-phenyl)carbonyl-pyrimidin-2-yl]-N-pyrrolidin-3-yl-methanesulfonamide Openeye Name: N-[4-amino-5-(5-fluoro-2-methoxy-benzoyl)pyrimidin-2-yl]-N-pyrrolidin-3-yl-methanesulfonamide CAS Name: N-[4-amino-5-[(5-fluoro-2-methoxyphenyl)-oxomethyl]-2-pyrimidinyl]-N-(3-pyrrolidinyl)methanesulfonamide IUPAC Name: N-[4-amino-5-(5-fluoro-2-methoxybenzoyl)pyrimidin-2-yl]-N-pyrrolidin-3-ylmethanesulfonamide Traditional Name: N-[4-amino-5-(5-fluoro-2-methoxy-benzoyl)pyrimidin-2-yl]-N-pyrrolidin-3-yl-methanesulfonamide Formula: C17H20FN5O4S MolecularWeight: 409.435203

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)F)C(=O)C2=CN=C(N=C2N)N(C3CCNC3)S(=O)(=O)C

Isomeric SMILES

COC1=C(C=C(C=C1)F)C(=O)C2=CN=C(N=C2N)N(C3CCNC3)S(=O)(=O)C

InChI

InChI=1S/C17H20FN5O4S/c1-27-14-4-3-10(18)7-12(14)15(24)13-9-21-17(22-16(13)19)23(28(2,25)26)11-5-6-20-8-11/h3-4,7,9,11,20H,5-6,8H2,1-2H3,(H2,19,21,22)