1-[[2,4-bis(fluoranyl)phenyl]methyl]-N-methoxy-3-(3-oxidanylidenepiperazin-1-yl)sulfonyl-pyrrolo[2,3-c]pyridine-5-carboxamide

Systemtic Name: 1-[[2,4-bis(fluoranyl)phenyl]methyl]-N-methoxy-3-(3-oxidanylidenepiperazin-1-yl)sulfonyl-pyrrolo[2,3-c]pyridine-5-carboxamide Openeye Name: 1-[(2,4-difluorophenyl)methyl]-N-methoxy-3-(3-oxopiperazin-1-yl)sulfonyl-pyrrolo[2,3-c]pyridine-5-carboxamide CAS Name: 1-[(2,4-difluorophenyl)methyl]-N-methoxy-3-[(3-oxo-1-piperazinyl)sulfonyl]-5-pyrrolo[2,3-c]pyridinecarboxamide IUPAC Name: 1-[(2,4-difluorophenyl)methyl]-N-methoxy-3-(3-oxopiperazin-1-yl)sulfonylpyrrolo[2,3-c]pyridine-5-carboxamide Traditional Name: 1-(2,4-difluorobenzyl)-3-(3-ketopiperazino)sulfonyl-N-methoxy-pyrrolo[2,3-c]pyridine-5-carboxamide Formula: C20H19F2N5O5S MolecularWeight: 479.457166

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Descriptors Computed from Structure

Canonical SMILES:

CONC(=O)C1=NC=C2C(=C1)C(=CN2CC3=C(C=C(C=C3)F)F)S(=O)(=O)N4CCNC(=O)C4

Isomeric SMILES

CONC(=O)C1=NC=C2C(=C1)C(=CN2CC3=C(C=C(C=C3)F)F)S(=O)(=O)N4CCNC(=O)C4

InChI

InChI=1S/C20H19F2N5O5S/c1-32-25-20(29)16-7-14-17(8-24-16)26(9-12-2-3-13(21)6-15(12)22)10-18(14)33(30,31)27-5-4-23-19(28)11-27/h2-3,6-8,10H,4-5,9,11H2,1H3,(H,23,28)(H,25,29)