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

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

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

CCC(=O)N1[C@H](CC(=N1)C2=CC(=CC=C2)NS(=O)(=O)C)C3=CC4=NC=CN=C4C=C3

InChI

InChI=1S/C21H21N5O3S/c1-3-21(27)26-20(15-7-8-17-19(12-15)23-10-9-22-17)13-18(24-26)14-5-4-6-16(11-14)25-30(2,28)29/h4-12,20,25H,3,13H2,1-2H3/t20-/m1/s1