1-[[4-(diethylsulfamoyl)-2-nitro-phenyl]amino]-3-[2-(3-prop-1-en-2-ylphenyl)propan-2-yl]urea

Systemtic Name: 1-[[4-(diethylsulfamoyl)-2-nitro-phenyl]amino]-3-[2-(3-prop-1-en-2-ylphenyl)propan-2-yl]urea Openeye Name: 1-[4-(diethylsulfamoyl)-2-nitro-anilino]-3-[1-(3-isopropenylphenyl)-1-methyl-ethyl]urea CAS Name: 1-[4-(diethylsulfamoyl)-2-nitroanilino]-3-[2-[3-(1-methylethenyl)phenyl]propan-2-yl]urea IUPAC Name: 1-[4-(diethylsulfamoyl)-2-nitroanilino]-3-[2-(3-prop-1-en-2-ylphenyl)propan-2-yl]urea Traditional Name: 1-[4-(diethylsulfamoyl)-2-nitro-anilino]-3-[1-(3-isopropenylphenyl)-1-methyl-ethyl]urea Formula: C23H31N5O5S MolecularWeight: 489.58774

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)S(=O)(=O)C1=CC(=C(C=C1)NNC(=O)NC(C)(C)C2=CC=CC(=C2)C(=C)C)[N+](=O)[O-]

Isomeric SMILES

CCN(CC)S(=O)(=O)C1=CC(=C(C=C1)NNC(=O)NC(C)(C)C2=CC=CC(=C2)C(=C)C)[N+](=O)[O-]

InChI

InChI=1S/C23H31N5O5S/c1-7-27(8-2)34(32,33)19-12-13-20(21(15-19)28(30)31)25-26-22(29)24-23(5,6)18-11-9-10-17(14-18)16(3)4/h9-15,25H,3,7-8H2,1-2,4-6H3,(H2,24,26,29)