1-(2-chloranyl-5-piperidin-1-ylsulfonyl-phenyl)-3-[2-(trifluoromethyl)phenyl]thiourea

Systemtic Name: 1-(2-chloranyl-5-piperidin-1-ylsulfonyl-phenyl)-3-[2-(trifluoromethyl)phenyl]thiourea Openeye Name: 1-[2-chloro-5-(1-piperidylsulfonyl)phenyl]-3-[2-(trifluoromethyl)phenyl]thiourea CAS Name: 1-[2-chloro-5-(1-piperidinylsulfonyl)phenyl]-3-[2-(trifluoromethyl)phenyl]thiourea IUPAC Name: 1-(2-chloro-5-piperidin-1-ylsulfonylphenyl)-3-[2-(trifluoromethyl)phenyl]thiourea Traditional Name: 1-(2-chloro-5-piperidinosulfonyl-phenyl)-3-[2-(trifluoromethyl)phenyl]thiourea Formula: C19H19ClF3N3O2S2 MolecularWeight: 477.95127

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(CC1)S(=O)(=O)C2=CC(=C(C=C2)Cl)NC(=S)NC3=CC=CC=C3C(F)(F)F

Isomeric SMILES

C1CCN(CC1)S(=O)(=O)C2=CC(=C(C=C2)Cl)NC(=S)NC3=CC=CC=C3C(F)(F)F

InChI

InChI=1S/C19H19ClF3N3O2S2/c20-15-9-8-13(30(27,28)26-10-4-1-5-11-26)12-17(15)25-18(29)24-16-7-3-2-6-14(16)19(21,22)23/h2-3,6-9,12H,1,4-5,10-11H2,(H2,24,25,29)