3-[(2-methoxy-5-nitro-phenyl)carbamoyl]-1-(4-methylphenyl)-1-methylsulfonyl-urea

Systemtic Name: 3-[(2-methoxy-5-nitro-phenyl)carbamoyl]-1-(4-methylphenyl)-1-methylsulfonyl-urea Openeye Name: 3-[(2-methoxy-5-nitro-phenyl)carbamoyl]-1-methylsulfonyl-1-(p-tolyl)urea CAS Name: 3-[(2-methoxy-5-nitroanilino)-oxomethyl]-1-(4-methylphenyl)-1-methylsulfonylurea IUPAC Name: 3-[(2-methoxy-5-nitrophenyl)carbamoyl]-1-(4-methylphenyl)-1-methylsulfonylurea Traditional Name: 1-mesyl-3-[(2-methoxy-5-nitro-phenyl)carbamoyl]-1-(p-tolyl)urea Formula: C17H18N4O7S MolecularWeight: 422.41242

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)N(C(=O)NC(=O)NC2=C(C=CC(=C2)[N+](=O)[O-])OC)S(=O)(=O)C

Isomeric SMILES

CC1=CC=C(C=C1)N(C(=O)NC(=O)NC2=C(C=CC(=C2)[N+](=O)[O-])OC)S(=O)(=O)C

InChI

InChI=1S/C17H18N4O7S/c1-11-4-6-12(7-5-11)20(29(3,26)27)17(23)19-16(22)18-14-10-13(21(24)25)8-9-15(14)28-2/h4-10H,1-3H3,(H2,18,19,22,23)