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

Systemtic Name: N-[4-[(3R)-2-propanoyl-5-quinoxalin-6-yl-3,4-dihydropyrazol-3-yl]phenyl]methanesulfonamide Openeye Name: N-[4-[(3R)-2-propanoyl-5-quinoxalin-6-yl-3,4-dihydropyrazol-3-yl]phenyl]methanesulfonamide CAS Name: N-[4-[(3R)-2-(1-oxopropyl)-5-(6-quinoxalinyl)-3,4-dihydropyrazol-3-yl]phenyl]methanesulfonamide IUPAC Name: N-[4-[(3R)-2-propanoyl-5-quinoxalin-6-yl-3,4-dihydropyrazol-3-yl]phenyl]methanesulfonamide Traditional Name: N-[4-[(3R)-2-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=CC3=NC=CN=C3C=C2)C4=CC=C(C=C4)NS(=O)(=O)C

Isomeric SMILES

CCC(=O)N1[C@H](CC(=N1)C2=CC3=NC=CN=C3C=C2)C4=CC=C(C=C4)NS(=O)(=O)C

InChI

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