1-cyclohexyl-3-[[2-[(2,4-dimethylphenyl)sulfamoyl]-4-nitro-phenyl]amino]urea

Systemtic Name: 1-cyclohexyl-3-[[2-[(2,4-dimethylphenyl)sulfamoyl]-4-nitro-phenyl]amino]urea Openeye Name: 1-cyclohexyl-3-[2-[(2,4-dimethylphenyl)sulfamoyl]-4-nitro-anilino]urea CAS Name: 1-cyclohexyl-3-[2-[(2,4-dimethylphenyl)sulfamoyl]-4-nitroanilino]urea IUPAC Name: 1-cyclohexyl-3-[2-[(2,4-dimethylphenyl)sulfamoyl]-4-nitroanilino]urea Traditional Name: 1-cyclohexyl-3-[2-[(2,4-dimethylphenyl)sulfamoyl]-4-nitro-anilino]urea Formula: C21H27N5O5S MolecularWeight: 461.53458

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)NS(=O)(=O)C2=C(C=CC(=C2)[N+](=O)[O-])NNC(=O)NC3CCCCC3)C

Isomeric SMILES

CC1=CC(=C(C=C1)NS(=O)(=O)C2=C(C=CC(=C2)[N+](=O)[O-])NNC(=O)NC3CCCCC3)C

InChI

InChI=1S/C21H27N5O5S/c1-14-8-10-18(15(2)12-14)25-32(30,31)20-13-17(26(28)29)9-11-19(20)23-24-21(27)22-16-6-4-3-5-7-16/h8-13,16,23,25H,3-7H2,1-2H3,(H2,22,24,27)