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3-nitro-N-propan-2-yl-4-[2-(1,2,4-triazol-1-yl)ethylamino]benzenesulfonamide
3-nitro-N-propan-2-yl-4-[2-(1,2,4-triazol-1-yl)ethylamino]benzenesulfonamide
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Descriptors Computed from Structure
Canonical SMILES:
CC(C)NS(=O)(=O)C1=CC(=C(C=C1)NCCN2C=NC=N2)[N+](=O)[O-]
Isomeric SMILES
CC(C)NS(=O)(=O)C1=CC(=C(C=C1)NCCN2C=NC=N2)[N+](=O)[O-]
InChI
InChI=1S/C13H18N6O4S/c1-10(2)17-24(22,23)11-3-4-12(13(7-11)19(20)21)15-5-6-18-9-14-8-16-18/h3-4,7-10,15,17H,5-6H2,1-2H3
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