(3-methylthiophen-2-yl)-[4-[3-(trifluoromethyl)phenyl]sulfonylpiperazin-1-yl]methanone

Systemtic Name: (3-methylthiophen-2-yl)-[4-[3-(trifluoromethyl)phenyl]sulfonylpiperazin-1-yl]methanone Openeye Name: (3-methyl-2-thienyl)-[4-[3-(trifluoromethyl)phenyl]sulfonylpiperazin-1-yl]methanone CAS Name: (3-methyl-2-thiophenyl)-[4-[3-(trifluoromethyl)phenyl]sulfonyl-1-piperazinyl]methanone IUPAC Name: (3-methylthiophen-2-yl)-[4-[3-(trifluoromethyl)phenyl]sulfonylpiperazin-1-yl]methanone Traditional Name: (3-methyl-2-thienyl)-[4-[3-(trifluoromethyl)phenyl]sulfonylpiperazino]methanone Formula: C17H17F3N2O3S2 MolecularWeight: 418.45369

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C17H17F3N2O3S2/c1-12-5-10-26-15(12)16(23)21-6-8-22(9-7-21)27(24,25)14-4-2-3-13(11-14)17(18,19)20/h2-5,10-11H,6-9H2,1H3