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N-[4-[cyano-[3-(phenethylamino)quinoxalin-2-yl]methyl]sulfonylphenyl]ethanamide
N-[4-[cyano-[3-(phenethylamino)quinoxalin-2-yl]methyl]sulfonylphenyl]ethanamide
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Descriptors Computed from Structure
Canonical SMILES:
CC(=O)NC1=CC=C(C=C1)S(=O)(=O)C(C#N)C2=NC3=CC=CC=C3N=C2NCCC4=CC=CC=C4
Isomeric SMILES
CC(=O)NC1=CC=C(C=C1)S(=O)(=O)C(C#N)C2=NC3=CC=CC=C3N=C2NCCC4=CC=CC=C4
InChI
InChI=1S/C26H23N5O3S/c1-18(32)29-20-11-13-21(14-12-20)35(33,34)24(17-27)25-26(28-16-15-19-7-3-2-4-8-19)31-23-10-6-5-9-22(23)30-25/h2-14,24H,15-16H2,1H3,(H,28,31)(H,29,32)
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