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

Systemtic Name: N2-(3-aminophenyl)-N4-(2,3-dihydro-1,4-benzodioxin-6-yl)-5-fluoranyl-pyrimidine-2,4-diamine Openeye Name: N2-(3-aminophenyl)-N4-(2,3-dihydro-1,4-benzodioxin-6-yl)-5-fluoro-pyrimidine-2,4-diamine CAS Name: N2-(3-aminophenyl)-N4-(2,3-dihydro-1,4-benzodioxin-6-yl)-5-fluoropyrimidine-2,4-diamine IUPAC Name: 2-N-(3-aminophenyl)-4-N-(2,3-dihydro-1,4-benzodioxin-6-yl)-5-fluoropyrimidine-2,4-diamine Traditional Name: [2-(3-aminoanilino)-5-fluoro-pyrimidin-4-yl]-(2,3-dihydro-1,4-benzodioxin-6-yl)amine Formula: C18H16FN5O2 MolecularWeight: 353.350343

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Descriptors Computed from Structure

Canonical SMILES:

C1COC2=C(O1)C=CC(=C2)NC3=NC(=NC=C3F)NC4=CC=CC(=C4)N

Isomeric SMILES

C1COC2=C(O1)C=CC(=C2)NC3=NC(=NC=C3F)NC4=CC=CC(=C4)N

InChI

InChI=1S/C18H16FN5O2/c19-14-10-21-18(23-12-3-1-2-11(20)8-12)24-17(14)22-13-4-5-15-16(9-13)26-7-6-25-15/h1-5,8-10H,6-7,20H2,(H2,21,22,23,24)