4-[(4-chlorophenyl)methyl]-N-(2-methylpropyl)piperazine-1-carbothioamide

Systemtic Name: 4-[(4-chlorophenyl)methyl]-N-(2-methylpropyl)piperazine-1-carbothioamide Openeye Name: 4-[(4-chlorophenyl)methyl]-N-isobutyl-piperazine-1-carbothioamide CAS Name: 4-[(4-chlorophenyl)methyl]-N-(2-methylpropyl)-1-piperazinecarbothioamide IUPAC Name: 4-[(4-chlorophenyl)methyl]-N-(2-methylpropyl)piperazine-1-carbothioamide Traditional Name: 4-(4-chlorobenzyl)-N-isobutyl-piperazine-1-carbothioamide Formula: C16H24ClN3S MolecularWeight: 325.89986

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CNC(=S)N1CCN(CC1)CC2=CC=C(C=C2)Cl

Isomeric SMILES

CC(C)CNC(=S)N1CCN(CC1)CC2=CC=C(C=C2)Cl

InChI

InChI=1S/C16H24ClN3S/c1-13(2)11-18-16(21)20-9-7-19(8-10-20)12-14-3-5-15(17)6-4-14/h3-6,13H,7-12H2,1-2H3,(H,18,21)