N-[2-(2-propanoyl-3-quinoxalin-6-yl-3,4-dihydropyrazol-5-yl)phenyl]methanesulfonamide

Systemtic Name: N-[2-(2-propanoyl-3-quinoxalin-6-yl-3,4-dihydropyrazol-5-yl)phenyl]methanesulfonamide Openeye Name: N-[2-(2-propanoyl-3-quinoxalin-6-yl-3,4-dihydropyrazol-5-yl)phenyl]methanesulfonamide CAS Name: N-[2-[2-(1-oxopropyl)-3-(6-quinoxalinyl)-3,4-dihydropyrazol-5-yl]phenyl]methanesulfonamide IUPAC Name: N-[2-(2-propanoyl-3-quinoxalin-6-yl-3,4-dihydropyrazol-5-yl)phenyl]methanesulfonamide Traditional Name: N-[2-(1-propionyl-5-quinoxalin-6-yl-2-pyrazolin-3-yl)phenyl]methanesulfonamide Formula: C21H21N5O3S MolecularWeight: 423.48814

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Descriptors Computed from Structure

Canonical SMILES:

CCC(=O)N1C(CC(=N1)C2=CC=CC=C2NS(=O)(=O)C)C3=CC4=NC=CN=C4C=C3

Isomeric SMILES

CCC(=O)N1C(CC(=N1)C2=CC=CC=C2NS(=O)(=O)C)C3=CC4=NC=CN=C4C=C3

InChI

InChI=1S/C21H21N5O3S/c1-3-21(27)26-20(14-8-9-17-19(12-14)23-11-10-22-17)13-18(24-26)15-6-4-5-7-16(15)25-30(2,28)29/h4-12,20,25H,3,13H2,1-2H3