N5-[6-[4-(dimethylaminomethyl)-3-fluoranyl-phenyl]pyrimidin-4-yl]-1H-indazole-3,5-diamine

Systemtic Name: N5-[6-[4-(dimethylaminomethyl)-3-fluoranyl-phenyl]pyrimidin-4-yl]-1H-indazole-3,5-diamine Openeye Name: N5-[6-[4-(dimethylaminomethyl)-3-fluoro-phenyl]pyrimidin-4-yl]-1H-indazole-3,5-diamine CAS Name: N5-[6-[4-(dimethylaminomethyl)-3-fluorophenyl]-4-pyrimidinyl]-1H-indazole-3,5-diamine IUPAC Name: 5-N-[6-[4-(dimethylaminomethyl)-3-fluorophenyl]pyrimidin-4-yl]-1H-indazole-3,5-diamine Traditional Name: [4-[6-[(3-amino-1H-indazol-5-yl)amino]pyrimidin-4-yl]-2-fluoro-benzyl]-dimethyl-amine Formula: C20H20FN7 MolecularWeight: 377.418103

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Descriptors Computed from Structure

Canonical SMILES:

CN(C)CC1=C(C=C(C=C1)C2=CC(=NC=N2)NC3=CC4=C(C=C3)NN=C4N)F

Isomeric SMILES

CN(C)CC1=C(C=C(C=C1)C2=CC(=NC=N2)NC3=CC4=C(C=C3)NN=C4N)F

InChI

InChI=1S/C20H20FN7/c1-28(2)10-13-4-3-12(7-16(13)21)18-9-19(24-11-23-18)25-14-5-6-17-15(8-14)20(22)27-26-17/h3-9,11H,10H2,1-2H3,(H3,22,26,27)(H,23,24,25)