5-cyclopropyl-1-[4-(3-fluoranyl-4-methoxy-phenyl)pyrimidin-2-yl]-N-(3-methylsulfanylpropyl)pyrazole-4-carboxamide

Systemtic Name: 5-cyclopropyl-1-[4-(3-fluoranyl-4-methoxy-phenyl)pyrimidin-2-yl]-N-(3-methylsulfanylpropyl)pyrazole-4-carboxamide Openeye Name: 5-cyclopropyl-1-[4-(3-fluoro-4-methoxy-phenyl)pyrimidin-2-yl]-N-(3-methylsulfanylpropyl)pyrazole-4-carboxamide CAS Name: 5-cyclopropyl-1-[4-(3-fluoro-4-methoxyphenyl)-2-pyrimidinyl]-N-[3-(methylthio)propyl]-4-pyrazolecarboxamide IUPAC Name: 5-cyclopropyl-1-[4-(3-fluoro-4-methoxyphenyl)pyrimidin-2-yl]-N-(3-methylsulfanylpropyl)pyrazole-4-carboxamide Traditional Name: 5-cyclopropyl-1-[4-(3-fluoro-4-methoxy-phenyl)pyrimidin-2-yl]-N-[3-(methylthio)propyl]pyrazole-4-carboxamide Formula: C22H24FN5O2S MolecularWeight: 441.521663

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)C2=NC(=NC=C2)N3C(=C(C=N3)C(=O)NCCCSC)C4CC4)F

Isomeric SMILES

COC1=C(C=C(C=C1)C2=NC(=NC=C2)N3C(=C(C=N3)C(=O)NCCCSC)C4CC4)F

InChI

InChI=1S/C22H24FN5O2S/c1-30-19-7-6-15(12-17(19)23)18-8-10-25-22(27-18)28-20(14-4-5-14)16(13-26-28)21(29)24-9-3-11-31-2/h6-8,10,12-14H,3-5,9,11H2,1-2H3,(H,24,29)