N-(2-dimethylaminoethyl)-4-[5-(trifluoromethyl)pyridin-2-yl]piperazine-1-carbothioamide

Systemtic Name: N-(2-dimethylaminoethyl)-4-[5-(trifluoromethyl)pyridin-2-yl]piperazine-1-carbothioamide Openeye Name: N-(2-dimethylaminoethyl)-4-[5-(trifluoromethyl)-2-pyridyl]piperazine-1-carbothioamide CAS Name: N-(2-dimethylaminoethyl)-4-[5-(trifluoromethyl)-2-pyridinyl]-1-piperazinecarbothioamide IUPAC Name: N-(2-dimethylaminoethyl)-4-[5-(trifluoromethyl)pyridin-2-yl]piperazine-1-carbothioamide Traditional Name: N-(2-dimethylaminoethyl)-4-[5-(trifluoromethyl)-2-pyridyl]piperazine-1-carbothioamide Formula: C15H22F3N5S MolecularWeight: 361.42889

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Descriptors Computed from Structure

Canonical SMILES:

CN(C)CCNC(=S)N1CCN(CC1)C2=NC=C(C=C2)C(F)(F)F

Isomeric SMILES

CN(C)CCNC(=S)N1CCN(CC1)C2=NC=C(C=C2)C(F)(F)F

InChI

InChI=1S/C15H22F3N5S/c1-21(2)6-5-19-14(24)23-9-7-22(8-10-23)13-4-3-12(11-20-13)15(16,17)18/h3-4,11H,5-10H2,1-2H3,(H,19,24)