1-(4,6-dimethoxy-1,3,5-triazin-2-yl)-3-[(2-nitrophenyl)methylsulfonyl]urea

Systemtic Name: 1-(4,6-dimethoxy-1,3,5-triazin-2-yl)-3-[(2-nitrophenyl)methylsulfonyl]urea Openeye Name: 1-(4,6-dimethoxy-1,3,5-triazin-2-yl)-3-[(2-nitrophenyl)methylsulfonyl]urea CAS Name: 1-(4,6-dimethoxy-1,3,5-triazin-2-yl)-3-[(2-nitrophenyl)methylsulfonyl]urea IUPAC Name: 1-(4,6-dimethoxy-1,3,5-triazin-2-yl)-3-[(2-nitrophenyl)methylsulfonyl]urea Traditional Name: 1-(4,6-dimethoxy-s-triazin-2-yl)-3-(2-nitrobenzyl)sulfonyl-urea Formula: C13H14N6O7S MolecularWeight: 398.35126

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Descriptors Computed from Structure

Canonical SMILES:

COC1=NC(=NC(=N1)NC(=O)NS(=O)(=O)CC2=CC=CC=C2[N+](=O)[O-])OC

Isomeric SMILES

COC1=NC(=NC(=N1)NC(=O)NS(=O)(=O)CC2=CC=CC=C2[N+](=O)[O-])OC

InChI

InChI=1S/C13H14N6O7S/c1-25-12-15-10(16-13(17-12)26-2)14-11(20)18-27(23,24)7-8-5-3-4-6-9(8)19(21)22/h3-6H,7H2,1-2H3,(H2,14,15,16,17,18,20)