N-(4-tert-butylphenyl)-4-[(4-fluorophenyl)methyl]piperazine-1-carbothioamide

Systemtic Name: N-(4-tert-butylphenyl)-4-[(4-fluorophenyl)methyl]piperazine-1-carbothioamide Openeye Name: N-(4-tert-butylphenyl)-4-[(4-fluorophenyl)methyl]piperazine-1-carbothioamide CAS Name: N-(4-tert-butylphenyl)-4-[(4-fluorophenyl)methyl]-1-piperazinecarbothioamide IUPAC Name: N-(4-tert-butylphenyl)-4-[(4-fluorophenyl)methyl]piperazine-1-carbothioamide Traditional Name: N-(4-tert-butylphenyl)-4-(4-fluorobenzyl)piperazine-1-carbothioamide Formula: C22H28FN3S MolecularWeight: 385.541223

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=CC=C(C=C1)NC(=S)N2CCN(CC2)CC3=CC=C(C=C3)F

Isomeric SMILES

CC(C)(C)C1=CC=C(C=C1)NC(=S)N2CCN(CC2)CC3=CC=C(C=C3)F

InChI

InChI=1S/C22H28FN3S/c1-22(2,3)18-6-10-20(11-7-18)24-21(27)26-14-12-25(13-15-26)16-17-4-8-19(23)9-5-17/h4-11H,12-16H2,1-3H3,(H,24,27)