4-[(3-methoxyphenyl)methyl]-N-[3-(trifluoromethyl)phenyl]piperazine-1-carbothioamide

Systemtic Name: 4-[(3-methoxyphenyl)methyl]-N-[3-(trifluoromethyl)phenyl]piperazine-1-carbothioamide Openeye Name: 4-[(3-methoxyphenyl)methyl]-N-[3-(trifluoromethyl)phenyl]piperazine-1-carbothioamide CAS Name: 4-[(3-methoxyphenyl)methyl]-N-[3-(trifluoromethyl)phenyl]-1-piperazinecarbothioamide IUPAC Name: 4-[(3-methoxyphenyl)methyl]-N-[3-(trifluoromethyl)phenyl]piperazine-1-carbothioamide Traditional Name: 4-m-anisyl-N-[3-(trifluoromethyl)phenyl]piperazine-1-carbothioamide Formula: C20H22F3N3OS MolecularWeight: 409.46839

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC(=C1)CN2CCN(CC2)C(=S)NC3=CC=CC(=C3)C(F)(F)F

Isomeric SMILES

COC1=CC=CC(=C1)CN2CCN(CC2)C(=S)NC3=CC=CC(=C3)C(F)(F)F

InChI

InChI=1S/C20H22F3N3OS/c1-27-18-7-2-4-15(12-18)14-25-8-10-26(11-9-25)19(28)24-17-6-3-5-16(13-17)20(21,22)23/h2-7,12-13H,8-11,14H2,1H3,(H,24,28)