1-[4-[4-(2,3,5,6-tetramethylphenyl)sulfonylpiperazin-1-yl]carbonylphenyl]urea

Systemtic Name: 1-[4-[4-(2,3,5,6-tetramethylphenyl)sulfonylpiperazin-1-yl]carbonylphenyl]urea Openeye Name: [4-[4-(2,3,5,6-tetramethylphenyl)sulfonylpiperazine-1-carbonyl]phenyl]urea CAS Name: [4-[oxo-[4-(2,3,5,6-tetramethylphenyl)sulfonyl-1-piperazinyl]methyl]phenyl]urea IUPAC Name: [4-[4-(2,3,5,6-tetramethylphenyl)sulfonylpiperazine-1-carbonyl]phenyl]urea Traditional Name: [4-[4-(2,3,5,6-tetramethylphenyl)sulfonylpiperazine-1-carbonyl]phenyl]urea Formula: C22H28N4O4S MolecularWeight: 444.54712

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C(=C1C)S(=O)(=O)N2CCN(CC2)C(=O)C3=CC=C(C=C3)NC(=O)N)C)C

Isomeric SMILES

CC1=CC(=C(C(=C1C)S(=O)(=O)N2CCN(CC2)C(=O)C3=CC=C(C=C3)NC(=O)N)C)C

InChI

InChI=1S/C22H28N4O4S/c1-14-13-15(2)17(4)20(16(14)3)31(29,30)26-11-9-25(10-12-26)21(27)18-5-7-19(8-6-18)24-22(23)28/h5-8,13H,9-12H2,1-4H3,(H3,23,24,28)