2-[5-[(3R)-1-(3-azanyl-1-methylsulfonyl-indazol-5-yl)-5-oxidanylidene-pyrrolidin-3-yl]-2-chloranyl-phenoxy]-3-fluoranyl-benzenecarbonitrile

Systemtic Name: 2-[5-[(3R)-1-(3-azanyl-1-methylsulfonyl-indazol-5-yl)-5-oxidanylidene-pyrrolidin-3-yl]-2-chloranyl-phenoxy]-3-fluoranyl-benzenecarbonitrile Openeye Name: 2-[5-[(3R)-1-(3-amino-1-methylsulfonyl-indazol-5-yl)-5-oxo-pyrrolidin-3-yl]-2-chloro-phenoxy]-3-fluoro-benzonitrile CAS Name: 2-[5-[(3R)-1-(3-amino-1-methylsulfonyl-5-indazolyl)-5-oxo-3-pyrrolidinyl]-2-chlorophenoxy]-3-fluorobenzonitrile IUPAC Name: 2-[5-[(3R)-1-(3-amino-1-methylsulfonylindazol-5-yl)-5-oxopyrrolidin-3-yl]-2-chlorophenoxy]-3-fluorobenzonitrile Traditional Name: 2-[5-[(3R)-1-(3-amino-1-mesyl-indazol-5-yl)-5-keto-pyrrolidin-3-yl]-2-chloro-phenoxy]-3-fluoro-benzonitrile Formula: C25H19ClFN5O4S MolecularWeight: 539.965863

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Descriptors Computed from Structure

Canonical SMILES:

CS(=O)(=O)N1C2=C(C=C(C=C2)N3CC(CC3=O)C4=CC(=C(C=C4)Cl)OC5=C(C=CC=C5F)C#N)C(=N1)N

Isomeric SMILES

CS(=O)(=O)N1C2=C(C=C(C=C2)N3C[C@H](CC3=O)C4=CC(=C(C=C4)Cl)OC5=C(C=CC=C5F)C#N)C(=N1)N

InChI

InChI=1S/C25H19ClFN5O4S/c1-37(34,35)32-21-8-6-17(11-18(21)25(29)30-32)31-13-16(10-23(31)33)14-5-7-19(26)22(9-14)36-24-15(12-28)3-2-4-20(24)27/h2-9,11,16H,10,13H2,1H3,(H2,29,30)/t16-/m0/s1