[3,5-bis(trifluoromethyl)phenyl]-[4-[3-(phenylmethyl)-1,2,4-thiadiazol-5-yl]piperazin-1-yl]methanone

Systemtic Name: [3,5-bis(trifluoromethyl)phenyl]-[4-[3-(phenylmethyl)-1,2,4-thiadiazol-5-yl]piperazin-1-yl]methanone Openeye Name: [4-(3-benzyl-1,2,4-thiadiazol-5-yl)piperazin-1-yl]-[3,5-bis(trifluoromethyl)phenyl]methanone CAS Name: [3,5-bis(trifluoromethyl)phenyl]-[4-[3-(phenylmethyl)-1,2,4-thiadiazol-5-yl]-1-piperazinyl]methanone IUPAC Name: [4-(3-benzyl-1,2,4-thiadiazol-5-yl)piperazin-1-yl]-[3,5-bis(trifluoromethyl)phenyl]methanone Traditional Name: [4-(3-benzyl-1,2,4-thiadiazol-5-yl)piperazino]-[3,5-bis(trifluoromethyl)phenyl]methanone Formula: C22H18F6N4OS MolecularWeight: 500.459939

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1C2=NC(=NS2)CC3=CC=CC=C3)C(=O)C4=CC(=CC(=C4)C(F)(F)F)C(F)(F)F

Isomeric SMILES

C1CN(CCN1C2=NC(=NS2)CC3=CC=CC=C3)C(=O)C4=CC(=CC(=C4)C(F)(F)F)C(F)(F)F

InChI

InChI=1S/C22H18F6N4OS/c23-21(24,25)16-11-15(12-17(13-16)22(26,27)28)19(33)31-6-8-32(9-7-31)20-29-18(30-34-20)10-14-4-2-1-3-5-14/h1-5,11-13H,6-10H2