5-[[[2,6-bis(fluoranyl)-3,5-dimethoxy-phenyl]amino]methyl]-N-cyclopropyl-2-methylsulfanyl-pyrimidin-4-amine

Systemtic Name: 5-[[[2,6-bis(fluoranyl)-3,5-dimethoxy-phenyl]amino]methyl]-N-cyclopropyl-2-methylsulfanyl-pyrimidin-4-amine Openeye Name: N-cyclopropyl-5-[(2,6-difluoro-3,5-dimethoxy-anilino)methyl]-2-methylsulfanyl-pyrimidin-4-amine CAS Name: N-cyclopropyl-5-[(2,6-difluoro-3,5-dimethoxyanilino)methyl]-2-(methylthio)-4-pyrimidinamine IUPAC Name: N-cyclopropyl-5-[(2,6-difluoro-3,5-dimethoxyanilino)methyl]-2-methylsulfanylpyrimidin-4-amine Traditional Name: cyclopropyl-[5-[(2,6-difluoro-3,5-dimethoxy-anilino)methyl]-2-(methylthio)pyrimidin-4-yl]amine Formula: C17H20F2N4O2S MolecularWeight: 382.428106

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=C(C(=C1F)NCC2=CN=C(N=C2NC3CC3)SC)F)OC

Isomeric SMILES

COC1=CC(=C(C(=C1F)NCC2=CN=C(N=C2NC3CC3)SC)F)OC

InChI

InChI=1S/C17H20F2N4O2S/c1-24-11-6-12(25-2)14(19)15(13(11)18)20-7-9-8-21-17(26-3)23-16(9)22-10-4-5-10/h6,8,10,20H,4-5,7H2,1-3H3,(H,21,22,23)