1-[2-(4-methylphenyl)sulfonyl-2-thiophen-2-yl-ethyl]-3-[4-(trifluoromethyl)phenyl]urea

Systemtic Name: 1-[2-(4-methylphenyl)sulfonyl-2-thiophen-2-yl-ethyl]-3-[4-(trifluoromethyl)phenyl]urea Openeye Name: 1-[2-(p-tolylsulfonyl)-2-(2-thienyl)ethyl]-3-[4-(trifluoromethyl)phenyl]urea CAS Name: 1-[2-(4-methylphenyl)sulfonyl-2-thiophen-2-ylethyl]-3-[4-(trifluoromethyl)phenyl]urea IUPAC Name: 1-[2-(4-methylphenyl)sulfonyl-2-thiophen-2-ylethyl]-3-[4-(trifluoromethyl)phenyl]urea Traditional Name: 1-[2-(2-thienyl)-2-tosyl-ethyl]-3-[4-(trifluoromethyl)phenyl]urea Formula: C21H19F3N2O3S2 MolecularWeight: 468.51237

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)C(CNC(=O)NC2=CC=C(C=C2)C(F)(F)F)C3=CC=CS3

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)C(CNC(=O)NC2=CC=C(C=C2)C(F)(F)F)C3=CC=CS3

InChI

InChI=1S/C21H19F3N2O3S2/c1-14-4-10-17(11-5-14)31(28,29)19(18-3-2-12-30-18)13-25-20(27)26-16-8-6-15(7-9-16)21(22,23)24/h2-12,19H,13H2,1H3,(H2,25,26,27)