4-[[(4S)-1-cyano-4-ethyl-7,8-bis(fluoranyl)-4H-pyrrolo[1,2-a]quinoxalin-5-yl]sulfonyl]-2-methyl-benzenesulfonamide

Systemtic Name: 4-[[(4S)-1-cyano-4-ethyl-7,8-bis(fluoranyl)-4H-pyrrolo[1,2-a]quinoxalin-5-yl]sulfonyl]-2-methyl-benzenesulfonamide Openeye Name: 4-[[(4S)-1-cyano-4-ethyl-7,8-difluoro-4H-pyrrolo[1,2-a]quinoxalin-5-yl]sulfonyl]-2-methyl-benzenesulfonamide CAS Name: 4-[[(4S)-1-cyano-4-ethyl-7,8-difluoro-4H-pyrrolo[1,2-a]quinoxalin-5-yl]sulfonyl]-2-methylbenzenesulfonamide IUPAC Name: 4-[[(4S)-1-cyano-4-ethyl-7,8-difluoro-4H-pyrrolo[1,2-a]quinoxalin-5-yl]sulfonyl]-2-methylbenzenesulfonamide Traditional Name: 4-[[(4S)-1-cyano-4-ethyl-7,8-difluoro-4H-pyrrolo[1,2-a]quinoxalin-5-yl]sulfonyl]-2-methyl-benzenesulfonamide Formula: C21H18F2N4O4S2 MolecularWeight: 492.518826

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Descriptors Computed from Structure

Canonical SMILES:

CCC1C2=CC=C(N2C3=CC(=C(C=C3N1S(=O)(=O)C4=CC(=C(C=C4)S(=O)(=O)N)C)F)F)C#N

Isomeric SMILES

CC[C@H]1C2=CC=C(N2C3=CC(=C(C=C3N1S(=O)(=O)C4=CC(=C(C=C4)S(=O)(=O)N)C)F)F)C#N

InChI

InChI=1S/C21H18F2N4O4S2/c1-3-17-18-6-4-13(11-24)26(18)19-9-15(22)16(23)10-20(19)27(17)33(30,31)14-5-7-21(12(2)8-14)32(25,28)29/h4-10,17H,3H2,1-2H3,(H2,25,28,29)/t17-/m0/s1