4-[(4-fluorophenyl)methyl]-N-(2-methoxy-5-methyl-phenyl)piperazine-1-carbothioamide

Systemtic Name: 4-[(4-fluorophenyl)methyl]-N-(2-methoxy-5-methyl-phenyl)piperazine-1-carbothioamide Openeye Name: 4-[(4-fluorophenyl)methyl]-N-(2-methoxy-5-methyl-phenyl)piperazine-1-carbothioamide CAS Name: 4-[(4-fluorophenyl)methyl]-N-(2-methoxy-5-methylphenyl)-1-piperazinecarbothioamide IUPAC Name: 4-[(4-fluorophenyl)methyl]-N-(2-methoxy-5-methylphenyl)piperazine-1-carbothioamide Traditional Name: 4-(4-fluorobenzyl)-N-(2-methoxy-5-methyl-phenyl)piperazine-1-carbothioamide Formula: C20H24FN3OS MolecularWeight: 373.487463

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)OC)NC(=S)N2CCN(CC2)CC3=CC=C(C=C3)F

Isomeric SMILES

CC1=CC(=C(C=C1)OC)NC(=S)N2CCN(CC2)CC3=CC=C(C=C3)F

InChI

InChI=1S/C20H24FN3OS/c1-15-3-8-19(25-2)18(13-15)22-20(26)24-11-9-23(10-12-24)14-16-4-6-17(21)7-5-16/h3-8,13H,9-12,14H2,1-2H3,(H,22,26)