N-[3-[(5-chloranyl-1H-pyrrolo[2,3-b]pyridin-3-yl)carbonyl]-2,4-bis(fluoranyl)phenyl]-1-methyl-pyrazole-3-sulfonamide

Systemtic Name: N-[3-[(5-chloranyl-1H-pyrrolo[2,3-b]pyridin-3-yl)carbonyl]-2,4-bis(fluoranyl)phenyl]-1-methyl-pyrazole-3-sulfonamide Openeye Name: N-[3-(5-chloro-1H-pyrrolo[2,3-b]pyridine-3-carbonyl)-2,4-difluoro-phenyl]-1-methyl-pyrazole-3-sulfonamide CAS Name: N-[3-[(5-chloro-1H-pyrrolo[2,3-b]pyridin-3-yl)-oxomethyl]-2,4-difluorophenyl]-1-methyl-3-pyrazolesulfonamide IUPAC Name: N-[3-(5-chloro-1H-pyrrolo[2,3-b]pyridine-3-carbonyl)-2,4-difluorophenyl]-1-methylpyrazole-3-sulfonamide Traditional Name: N-[3-(5-chloro-1H-pyrrolo[2,3-b]pyridine-3-carbonyl)-2,4-difluoro-phenyl]-1-methyl-pyrazole-3-sulfonamide Formula: C18H12ClF2N5O3S MolecularWeight: 451.834386

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Descriptors Computed from Structure

Canonical SMILES:

CN1C=CC(=N1)S(=O)(=O)NC2=C(C(=C(C=C2)F)C(=O)C3=CNC4=NC=C(C=C34)Cl)F

Isomeric SMILES

CN1C=CC(=N1)S(=O)(=O)NC2=C(C(=C(C=C2)F)C(=O)C3=CNC4=NC=C(C=C34)Cl)F

InChI

InChI=1S/C18H12ClF2N5O3S/c1-26-5-4-14(24-26)30(28,29)25-13-3-2-12(20)15(16(13)21)17(27)11-8-23-18-10(11)6-9(19)7-22-18/h2-8,25H,1H3,(H,22,23)