(3-phenylthiophen-2-yl)-[4-[5-(trifluoromethyl)pyridin-2-yl]piperazin-1-yl]methanone

Systemtic Name: (3-phenylthiophen-2-yl)-[4-[5-(trifluoromethyl)pyridin-2-yl]piperazin-1-yl]methanone Openeye Name: (3-phenyl-2-thienyl)-[4-[5-(trifluoromethyl)-2-pyridyl]piperazin-1-yl]methanone CAS Name: (3-phenyl-2-thiophenyl)-[4-[5-(trifluoromethyl)-2-pyridinyl]-1-piperazinyl]methanone IUPAC Name: (3-phenylthiophen-2-yl)-[4-[5-(trifluoromethyl)pyridin-2-yl]piperazin-1-yl]methanone Traditional Name: (3-phenyl-2-thienyl)-[4-[5-(trifluoromethyl)-2-pyridyl]piperazino]methanone Formula: C21H18F3N3OS MolecularWeight: 417.44733

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1C2=NC=C(C=C2)C(F)(F)F)C(=O)C3=C(C=CS3)C4=CC=CC=C4

Isomeric SMILES

C1CN(CCN1C2=NC=C(C=C2)C(F)(F)F)C(=O)C3=C(C=CS3)C4=CC=CC=C4

InChI

InChI=1S/C21H18F3N3OS/c22-21(23,24)16-6-7-18(25-14-16)26-9-11-27(12-10-26)20(28)19-17(8-13-29-19)15-4-2-1-3-5-15/h1-8,13-14H,9-12H2