1-[4-cyano-2-(phenylsulfonylamino)phenyl]-3-(2-methyl-3-nitro-phenyl)urea

Systemtic Name: 1-[4-cyano-2-(phenylsulfonylamino)phenyl]-3-(2-methyl-3-nitro-phenyl)urea Openeye Name: 1-[2-(benzenesulfonamido)-4-cyano-phenyl]-3-(2-methyl-3-nitro-phenyl)urea CAS Name: 1-[2-(benzenesulfonamido)-4-cyanophenyl]-3-(2-methyl-3-nitrophenyl)urea IUPAC Name: 1-[2-(benzenesulfonamido)-4-cyanophenyl]-3-(2-methyl-3-nitrophenyl)urea Traditional Name: 1-[2-(benzenesulfonamido)-4-cyano-phenyl]-3-(2-methyl-3-nitro-phenyl)urea Formula: C21H17N5O5S MolecularWeight: 451.45518

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC=C1[N+](=O)[O-])NC(=O)NC2=C(C=C(C=C2)C#N)NS(=O)(=O)C3=CC=CC=C3

Isomeric SMILES

CC1=C(C=CC=C1[N+](=O)[O-])NC(=O)NC2=C(C=C(C=C2)C#N)NS(=O)(=O)C3=CC=CC=C3

InChI

InChI=1S/C21H17N5O5S/c1-14-17(8-5-9-20(14)26(28)29)23-21(27)24-18-11-10-15(13-22)12-19(18)25-32(30,31)16-6-3-2-4-7-16/h2-12,25H,1H3,(H2,23,24,27)