7-[7-fluoranyl-6-[2-fluoranyl-4-(2-methylsulfonylphenyl)phenyl]-3-methyl-indazol-1-yl]isoquinolin-1-amine

Systemtic Name: 7-[7-fluoranyl-6-[2-fluoranyl-4-(2-methylsulfonylphenyl)phenyl]-3-methyl-indazol-1-yl]isoquinolin-1-amine Openeye Name: 7-[7-fluoro-6-[2-fluoro-4-(2-methylsulfonylphenyl)phenyl]-3-methyl-indazol-1-yl]isoquinolin-1-amine CAS Name: 7-[7-fluoro-6-[2-fluoro-4-(2-methylsulfonylphenyl)phenyl]-3-methyl-1-indazolyl]-1-isoquinolinamine IUPAC Name: 7-[7-fluoro-6-[2-fluoro-4-(2-methylsulfonylphenyl)phenyl]-3-methylindazol-1-yl]isoquinolin-1-amine Traditional Name: [7-[7-fluoro-6-[2-fluoro-4-(2-mesylphenyl)phenyl]-3-methyl-indazol-1-yl]-1-isoquinolyl]amine Formula: C30H22F2N4O2S MolecularWeight: 540.583086

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NN(C2=C1C=CC(=C2F)C3=C(C=C(C=C3)C4=CC=CC=C4S(=O)(=O)C)F)C5=CC6=C(C=C5)C=CN=C6N

Isomeric SMILES

CC1=NN(C2=C1C=CC(=C2F)C3=C(C=C(C=C3)C4=CC=CC=C4S(=O)(=O)C)F)C5=CC6=C(C=C5)C=CN=C6N

InChI

InChI=1S/C30H22F2N4O2S/c1-17-21-11-12-24(23-10-8-19(15-26(23)31)22-5-3-4-6-27(22)39(2,37)38)28(32)29(21)36(35-17)20-9-7-18-13-14-34-30(33)25(18)16-20/h3-16H,1-2H3,(H2,33,34)