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

Systemtic Name: 1-[3-[4-(2,5-dimethylphenyl)sulfonylpiperazin-1-yl]carbonylphenyl]urea Openeye Name: [3-[4-(2,5-dimethylphenyl)sulfonylpiperazine-1-carbonyl]phenyl]urea CAS Name: [3-[[4-(2,5-dimethylphenyl)sulfonyl-1-piperazinyl]-oxomethyl]phenyl]urea IUPAC Name: [3-[4-(2,5-dimethylphenyl)sulfonylpiperazine-1-carbonyl]phenyl]urea Traditional Name: [3-[4-(2,5-dimethylphenyl)sulfonylpiperazine-1-carbonyl]phenyl]urea Formula: C20H24N4O4S MolecularWeight: 416.49396

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)C)S(=O)(=O)N2CCN(CC2)C(=O)C3=CC(=CC=C3)NC(=O)N

Isomeric SMILES

CC1=CC(=C(C=C1)C)S(=O)(=O)N2CCN(CC2)C(=O)C3=CC(=CC=C3)NC(=O)N

InChI

InChI=1S/C20H24N4O4S/c1-14-6-7-15(2)18(12-14)29(27,28)24-10-8-23(9-11-24)19(25)16-4-3-5-17(13-16)22-20(21)26/h3-7,12-13H,8-11H2,1-2H3,(H3,21,22,26)