[4-[3,5-bis(trifluoromethyl)phenyl]sulfonylpiperazin-1-yl]-pyridin-3-yl-methanone

Systemtic Name: [4-[3,5-bis(trifluoromethyl)phenyl]sulfonylpiperazin-1-yl]-pyridin-3-yl-methanone Openeye Name: [4-[3,5-bis(trifluoromethyl)phenyl]sulfonylpiperazin-1-yl]-(3-pyridyl)methanone CAS Name: [4-[3,5-bis(trifluoromethyl)phenyl]sulfonyl-1-piperazinyl]-(3-pyridinyl)methanone IUPAC Name: [4-[3,5-bis(trifluoromethyl)phenyl]sulfonylpiperazin-1-yl]-pyridin-3-ylmethanone Traditional Name: [4-[3,5-bis(trifluoromethyl)phenyl]sulfonylpiperazino]-(3-pyridyl)methanone Formula: C18H15F6N3O3S MolecularWeight: 467.385419

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C18H15F6N3O3S/c19-17(20,21)13-8-14(18(22,23)24)10-15(9-13)31(29,30)27-6-4-26(5-7-27)16(28)12-2-1-3-25-11-12/h1-3,8-11H,4-7H2