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

Systemtic Name: 1-(3-azanyl-2-methyl-phenyl)-3-[4-cyano-2-(phenylsulfonylamino)phenyl]urea Openeye Name: 1-(3-amino-2-methyl-phenyl)-3-[2-(benzenesulfonamido)-4-cyano-phenyl]urea CAS Name: 1-(3-amino-2-methylphenyl)-3-[2-(benzenesulfonamido)-4-cyanophenyl]urea IUPAC Name: 1-(3-amino-2-methylphenyl)-3-[2-(benzenesulfonamido)-4-cyanophenyl]urea Traditional Name: 1-(3-amino-2-methyl-phenyl)-3-[2-(benzenesulfonamido)-4-cyano-phenyl]urea Formula: C21H19N5O3S MolecularWeight: 421.47226

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC=C1NC(=O)NC2=C(C=C(C=C2)C#N)NS(=O)(=O)C3=CC=CC=C3)N

Isomeric SMILES

CC1=C(C=CC=C1NC(=O)NC2=C(C=C(C=C2)C#N)NS(=O)(=O)C3=CC=CC=C3)N

InChI

InChI=1S/C21H19N5O3S/c1-14-17(23)8-5-9-18(14)24-21(27)25-19-11-10-15(13-22)12-20(19)26-30(28,29)16-6-3-2-4-7-16/h2-12,26H,23H2,1H3,(H2,24,25,27)