1-[3-[4-[3-(trifluoromethyl)phenyl]sulfonylpiperazin-1-yl]carbonylphenyl]urea

Systemtic Name: 1-[3-[4-[3-(trifluoromethyl)phenyl]sulfonylpiperazin-1-yl]carbonylphenyl]urea Openeye Name: [3-[4-[3-(trifluoromethyl)phenyl]sulfonylpiperazine-1-carbonyl]phenyl]urea CAS Name: [3-[oxo-[4-[3-(trifluoromethyl)phenyl]sulfonyl-1-piperazinyl]methyl]phenyl]urea IUPAC Name: [3-[4-[3-(trifluoromethyl)phenyl]sulfonylpiperazine-1-carbonyl]phenyl]urea Traditional Name: [3-[4-[3-(trifluoromethyl)phenyl]sulfonylpiperazine-1-carbonyl]phenyl]urea Formula: C19H19F3N4O4S MolecularWeight: 456.43877

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1C(=O)C2=CC(=CC=C2)NC(=O)N)S(=O)(=O)C3=CC=CC(=C3)C(F)(F)F

Isomeric SMILES

C1CN(CCN1C(=O)C2=CC(=CC=C2)NC(=O)N)S(=O)(=O)C3=CC=CC(=C3)C(F)(F)F

InChI

InChI=1S/C19H19F3N4O4S/c20-19(21,22)14-4-2-6-16(12-14)31(29,30)26-9-7-25(8-10-26)17(27)13-3-1-5-15(11-13)24-18(23)28/h1-6,11-12H,7-10H2,(H3,23,24,28)