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

Systemtic Name: 4-[(4-chlorophenyl)methyl]-N-methyl-piperazine-1-carbothioamide Openeye Name: 4-[(4-chlorophenyl)methyl]-N-methyl-piperazine-1-carbothioamide CAS Name: 4-[(4-chlorophenyl)methyl]-N-methyl-1-piperazinecarbothioamide IUPAC Name: 4-[(4-chlorophenyl)methyl]-N-methylpiperazine-1-carbothioamide Traditional Name: 4-(4-chlorobenzyl)-N-methyl-piperazine-1-carbothioamide Formula: C13H18ClN3S MolecularWeight: 283.82012

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C13H18ClN3S/c1-15-13(18)17-8-6-16(7-9-17)10-11-2-4-12(14)5-3-11/h2-5H,6-10H2,1H3,(H,15,18)