1-[ethyl-[2-(2-hydroxyethylsulfonyl)-6-nitro-phenyl]amino]-1-phenyl-urea

Systemtic Name: 1-[ethyl-[2-(2-hydroxyethylsulfonyl)-6-nitro-phenyl]amino]-1-phenyl-urea Openeye Name: 1-[N-ethyl-2-(2-hydroxyethylsulfonyl)-6-nitro-anilino]-1-phenyl-urea CAS Name: 1-[N-ethyl-2-(2-hydroxyethylsulfonyl)-6-nitroanilino]-1-phenylurea IUPAC Name: 1-[N-ethyl-2-(2-hydroxyethylsulfonyl)-6-nitroanilino]-1-phenylurea Traditional Name: 1-[N-ethyl-2-(2-hydroxyethylsulfonyl)-6-nitro-anilino]-1-phenyl-urea Formula: C17H20N4O6S MolecularWeight: 408.4289

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Descriptors Computed from Structure

Canonical SMILES:

CCN(C1=C(C=CC=C1S(=O)(=O)CCO)[N+](=O)[O-])N(C2=CC=CC=C2)C(=O)N

Isomeric SMILES

CCN(C1=C(C=CC=C1S(=O)(=O)CCO)[N+](=O)[O-])N(C2=CC=CC=C2)C(=O)N

InChI

InChI=1S/C17H20N4O6S/c1-2-19(20(17(18)23)13-7-4-3-5-8-13)16-14(21(24)25)9-6-10-15(16)28(26,27)12-11-22/h3-10,22H,2,11-12H2,1H3,(H2,18,23)