N-[(2S)-3-oxidanyl-1-oxidanylidene-1-[(5-phenyl-1H-pyrazol-3-yl)amino]propan-2-yl]quinoxaline-2-carboxamide

Systemtic Name: N-[(2S)-3-oxidanyl-1-oxidanylidene-1-[(5-phenyl-1H-pyrazol-3-yl)amino]propan-2-yl]quinoxaline-2-carboxamide Openeye Name: N-[(1S)-1-(hydroxymethyl)-2-oxo-2-[(5-phenyl-1H-pyrazol-3-yl)amino]ethyl]quinoxaline-2-carboxamide CAS Name: N-[(2S)-3-hydroxy-1-oxo-1-[(5-phenyl-1H-pyrazol-3-yl)amino]propan-2-yl]-2-quinoxalinecarboxamide IUPAC Name: N-[(2S)-3-hydroxy-1-oxo-1-[(5-phenyl-1H-pyrazol-3-yl)amino]propan-2-yl]quinoxaline-2-carboxamide Traditional Name: N-[(1S)-2-keto-1-methylol-2-[(5-phenyl-1H-pyrazol-3-yl)amino]ethyl]quinoxaline-2-carboxamide Formula: C21H18N6O3 MolecularWeight: 402.40602

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C2=CC(=NN2)NC(=O)C(CO)NC(=O)C3=NC4=CC=CC=C4N=C3

Isomeric SMILES

C1=CC=C(C=C1)C2=CC(=NN2)NC(=O)[C@H](CO)NC(=O)C3=NC4=CC=CC=C4N=C3

InChI

InChI=1S/C21H18N6O3/c28-12-18(24-20(29)17-11-22-14-8-4-5-9-15(14)23-17)21(30)25-19-10-16(26-27-19)13-6-2-1-3-7-13/h1-11,18,28H,12H2,(H,24,29)(H2,25,26,27,30)/t18-/m0/s1