1-methyl-3-[(4-methyl-3-nitro-phenyl)carbamoyl]-1-methylsulfonyl-urea

Systemtic Name: 1-methyl-3-[(4-methyl-3-nitro-phenyl)carbamoyl]-1-methylsulfonyl-urea Openeye Name: 1-methyl-3-[(4-methyl-3-nitro-phenyl)carbamoyl]-1-methylsulfonyl-urea CAS Name: 1-methyl-3-[(4-methyl-3-nitroanilino)-oxomethyl]-1-methylsulfonylurea IUPAC Name: 1-methyl-3-[(4-methyl-3-nitrophenyl)carbamoyl]-1-methylsulfonylurea Traditional Name: 1-mesyl-1-methyl-3-[(4-methyl-3-nitro-phenyl)carbamoyl]urea Formula: C11H14N4O6S MolecularWeight: 330.31706

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)NC(=O)NC(=O)N(C)S(=O)(=O)C)[N+](=O)[O-]

Isomeric SMILES

CC1=C(C=C(C=C1)NC(=O)NC(=O)N(C)S(=O)(=O)C)[N+](=O)[O-]

InChI

InChI=1S/C11H14N4O6S/c1-7-4-5-8(6-9(7)15(18)19)12-10(16)13-11(17)14(2)22(3,20)21/h4-6H,1-3H3,(H2,12,13,16,17)