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N-methyl-3-nitro-4-[3-(pyrimidin-2-ylamino)propylamino]benzenesulfonamide
N-methyl-3-nitro-4-[3-(pyrimidin-2-ylamino)propylamino]benzenesulfonamide
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Descriptors Computed from Structure
Canonical SMILES:
CNS(=O)(=O)C1=CC(=C(C=C1)NCCCNC2=NC=CC=N2)[N+](=O)[O-]
Isomeric SMILES
CNS(=O)(=O)C1=CC(=C(C=C1)NCCCNC2=NC=CC=N2)[N+](=O)[O-]
InChI
InChI=1S/C14H18N6O4S/c1-15-25(23,24)11-4-5-12(13(10-11)20(21)22)16-6-2-7-17-14-18-8-3-9-19-14/h3-5,8-10,15-16H,2,6-7H2,1H3,(H,17,18,19)
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- 3-(3-hydroxyphenyl)propanoic acid
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- N-[2-nitro-4-(trifluoromethyl)phenyl]-N'-pyrimidin-2-yl-propane-1,3-diamine
- N'-pyrimidin-2-yl-N-(5,6,7,8-tetrahydro-[1]benzothiolo[2,3-d]pyrimidin-4-yl)propane-1,3-diamine
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