1-[3,5-dimethyl-4-(nitromethylsulfonyl)phenyl]-3-(2-methylphenyl)sulfonyl-urea

Systemtic Name: 1-[3,5-dimethyl-4-(nitromethylsulfonyl)phenyl]-3-(2-methylphenyl)sulfonyl-urea Openeye Name: 1-[3,5-dimethyl-4-(nitromethylsulfonyl)phenyl]-3-(o-tolylsulfonyl)urea CAS Name: 1-[3,5-dimethyl-4-(nitromethylsulfonyl)phenyl]-3-(2-methylphenyl)sulfonylurea IUPAC Name: 1-[3,5-dimethyl-4-(nitromethylsulfonyl)phenyl]-3-(2-methylphenyl)sulfonylurea Traditional Name: 1-[3,5-dimethyl-4-(nitromethylsulfonyl)phenyl]-3-(o-tolylsulfonyl)urea Formula: C17H19N3O7S2 MolecularWeight: 441.47866

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1S(=O)(=O)NC(=O)NC2=CC(=C(C(=C2)C)S(=O)(=O)C[N+](=O)[O-])C

Isomeric SMILES

CC1=CC=CC=C1S(=O)(=O)NC(=O)NC2=CC(=C(C(=C2)C)S(=O)(=O)C[N+](=O)[O-])C

InChI

InChI=1S/C17H19N3O7S2/c1-11-6-4-5-7-15(11)29(26,27)19-17(21)18-14-8-12(2)16(13(3)9-14)28(24,25)10-20(22)23/h4-9H,10H2,1-3H3,(H2,18,19,21)