N2-(3-chloranyl-5-methoxy-phenyl)-N4-(2,3-dihydro-1,4-benzodioxin-6-yl)-5-fluoranyl-pyrimidine-2,4-diamine

Systemtic Name: N2-(3-chloranyl-5-methoxy-phenyl)-N4-(2,3-dihydro-1,4-benzodioxin-6-yl)-5-fluoranyl-pyrimidine-2,4-diamine Openeye Name: N2-(3-chloro-5-methoxy-phenyl)-N4-(2,3-dihydro-1,4-benzodioxin-6-yl)-5-fluoro-pyrimidine-2,4-diamine CAS Name: N2-(3-chloro-5-methoxyphenyl)-N4-(2,3-dihydro-1,4-benzodioxin-6-yl)-5-fluoropyrimidine-2,4-diamine IUPAC Name: 2-N-(3-chloro-5-methoxyphenyl)-4-N-(2,3-dihydro-1,4-benzodioxin-6-yl)-5-fluoropyrimidine-2,4-diamine Traditional Name: [2-(3-chloro-5-methoxy-anilino)-5-fluoro-pyrimidin-4-yl]-(2,3-dihydro-1,4-benzodioxin-6-yl)amine Formula: C19H16ClFN4O3 MolecularWeight: 402.806743

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=CC(=C1)NC2=NC=C(C(=N2)NC3=CC4=C(C=C3)OCCO4)F)Cl

Isomeric SMILES

COC1=CC(=CC(=C1)NC2=NC=C(C(=N2)NC3=CC4=C(C=C3)OCCO4)F)Cl

InChI

InChI=1S/C19H16ClFN4O3/c1-26-14-7-11(20)6-13(8-14)24-19-22-10-15(21)18(25-19)23-12-2-3-16-17(9-12)28-5-4-27-16/h2-3,6-10H,4-5H2,1H3,(H2,22,23,24,25)