N4-[4-[(3-azanyl-1,2-benzoxazol-4-yl)oxy]-3-fluoranyl-phenyl]-6-chloranyl-pyrimidine-2,4-diamine

Systemtic Name: N4-[4-[(3-azanyl-1,2-benzoxazol-4-yl)oxy]-3-fluoranyl-phenyl]-6-chloranyl-pyrimidine-2,4-diamine Openeye Name: N4-[4-[(3-amino-1,2-benzoxazol-4-yl)oxy]-3-fluoro-phenyl]-6-chloro-pyrimidine-2,4-diamine CAS Name: N4-[4-[(3-amino-1,2-benzoxazol-4-yl)oxy]-3-fluorophenyl]-6-chloropyrimidine-2,4-diamine IUPAC Name: 4-N-[4-[(3-amino-1,2-benzoxazol-4-yl)oxy]-3-fluorophenyl]-6-chloropyrimidine-2,4-diamine Traditional Name: (2-amino-6-chloro-pyrimidin-4-yl)-[4-(3-aminoindoxazen-4-yl)oxy-3-fluoro-phenyl]amine Formula: C17H12ClFN6O2 MolecularWeight: 386.767583

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC2=C(C(=C1)OC3=C(C=C(C=C3)NC4=CC(=NC(=N4)N)Cl)F)C(=NO2)N

Isomeric SMILES

C1=CC2=C(C(=C1)OC3=C(C=C(C=C3)NC4=CC(=NC(=N4)N)Cl)F)C(=NO2)N

InChI

InChI=1S/C17H12ClFN6O2/c18-13-7-14(24-17(21)23-13)22-8-4-5-10(9(19)6-8)26-11-2-1-3-12-15(11)16(20)25-27-12/h1-7H,(H2,20,25)(H3,21,22,23,24)