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

Systemtic Name: 5-[[[2,6-bis(fluoranyl)-3,5-dimethoxy-phenyl]amino]methyl]-N-cyclopentyl-2-methylsulfanyl-pyrimidin-4-amine Openeye Name: N-cyclopentyl-5-[(2,6-difluoro-3,5-dimethoxy-anilino)methyl]-2-methylsulfanyl-pyrimidin-4-amine CAS Name: N-cyclopentyl-5-[(2,6-difluoro-3,5-dimethoxyanilino)methyl]-2-(methylthio)-4-pyrimidinamine IUPAC Name: N-cyclopentyl-5-[(2,6-difluoro-3,5-dimethoxyanilino)methyl]-2-methylsulfanylpyrimidin-4-amine Traditional Name: cyclopentyl-[5-[(2,6-difluoro-3,5-dimethoxy-anilino)methyl]-2-(methylthio)pyrimidin-4-yl]amine Formula: C19H24F2N4O2S MolecularWeight: 410.481266

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=C(C(=C1F)NCC2=CN=C(N=C2NC3CCCC3)SC)F)OC

Isomeric SMILES

COC1=CC(=C(C(=C1F)NCC2=CN=C(N=C2NC3CCCC3)SC)F)OC

InChI

InChI=1S/C19H24F2N4O2S/c1-26-13-8-14(27-2)16(21)17(15(13)20)22-9-11-10-23-19(28-3)25-18(11)24-12-6-4-5-7-12/h8,10,12,22H,4-7,9H2,1-3H3,(H,23,24,25)