[2-[6-[aminocarbonyl-[2,6-bis(fluoranyl)phenyl]amino]pyridin-2-yl]-6-chloranyl-phenyl]methyl (2S)-2-azanyl-3-oxidanyl-propanoate

Systemtic Name: [2-[6-[aminocarbonyl-[2,6-bis(fluoranyl)phenyl]amino]pyridin-2-yl]-6-chloranyl-phenyl]methyl (2S)-2-azanyl-3-oxidanyl-propanoate Openeye Name: [2-[6-(N-carbamoyl-2,6-difluoro-anilino)-2-pyridyl]-6-chloro-phenyl]methyl (2S)-2-amino-3-hydroxy-propanoate CAS Name: (2S)-2-amino-3-hydroxypropanoic acid [2-[6-(N-carbamoyl-2,6-difluoroanilino)-2-pyridinyl]-6-chlorophenyl]methyl ester IUPAC Name: [2-[6-(N-carbamoyl-2,6-difluoroanilino)pyridin-2-yl]-6-chlorophenyl]methyl (2S)-2-amino-3-hydroxypropanoate Traditional Name: (2S)-2-amino-3-hydroxy-propionic acid [2-[6-(N-carbamoyl-2,6-difluoro-anilino)-2-pyridyl]-6-chloro-benzyl] ester Formula: C22H19ClF2N4O4 MolecularWeight: 476.860466

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=C(C(=C1)Cl)COC(=O)C(CO)N)C2=NC(=CC=C2)N(C3=C(C=CC=C3F)F)C(=O)N

Isomeric SMILES

C1=CC(=C(C(=C1)Cl)COC(=O)[C@H](CO)N)C2=NC(=CC=C2)N(C3=C(C=CC=C3F)F)C(=O)N

InChI

InChI=1S/C22H19ClF2N4O4/c23-14-5-1-4-12(13(14)11-33-21(31)17(26)10-30)18-8-3-9-19(28-18)29(22(27)32)20-15(24)6-2-7-16(20)25/h1-9,17,30H,10-11,26H2,(H2,27,32)/t17-/m0/s1