[4-(3-methyl-4-propan-2-yloxy-phenyl)sulfonylpiperazin-1-yl]-[4-(trifluoromethyl)phenyl]methanone

Systemtic Name: [4-(3-methyl-4-propan-2-yloxy-phenyl)sulfonylpiperazin-1-yl]-[4-(trifluoromethyl)phenyl]methanone Openeye Name: [4-(4-isopropoxy-3-methyl-phenyl)sulfonylpiperazin-1-yl]-[4-(trifluoromethyl)phenyl]methanone CAS Name: [4-(3-methyl-4-propan-2-yloxyphenyl)sulfonyl-1-piperazinyl]-[4-(trifluoromethyl)phenyl]methanone IUPAC Name: [4-(3-methyl-4-propan-2-yloxyphenyl)sulfonylpiperazin-1-yl]-[4-(trifluoromethyl)phenyl]methanone Traditional Name: [4-(4-isopropoxy-3-methyl-phenyl)sulfonylpiperazino]-[4-(trifluoromethyl)phenyl]methanone Formula: C22H25F3N2O4S MolecularWeight: 470.50511

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1)S(=O)(=O)N2CCN(CC2)C(=O)C3=CC=C(C=C3)C(F)(F)F)OC(C)C

Isomeric SMILES

CC1=C(C=CC(=C1)S(=O)(=O)N2CCN(CC2)C(=O)C3=CC=C(C=C3)C(F)(F)F)OC(C)C

InChI

InChI=1S/C22H25F3N2O4S/c1-15(2)31-20-9-8-19(14-16(20)3)32(29,30)27-12-10-26(11-13-27)21(28)17-4-6-18(7-5-17)22(23,24)25/h4-9,14-15H,10-13H2,1-3H3