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

Systemtic Name: 4-[(4-cyanophenyl)methyl]-N-methyl-piperazine-1-carbothioamide Openeye Name: 4-[(4-cyanophenyl)methyl]-N-methyl-piperazine-1-carbothioamide CAS Name: 4-[(4-cyanophenyl)methyl]-N-methyl-1-piperazinecarbothioamide IUPAC Name: 4-[(4-cyanophenyl)methyl]-N-methylpiperazine-1-carbothioamide Traditional Name: 4-(4-cyanobenzyl)-N-methyl-piperazine-1-carbothioamide Formula: C14H18N4S MolecularWeight: 274.38452

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Descriptors Computed from Structure

Canonical SMILES:

CNC(=S)N1CCN(CC1)CC2=CC=C(C=C2)C#N

Isomeric SMILES

CNC(=S)N1CCN(CC1)CC2=CC=C(C=C2)C#N

InChI

InChI=1S/C14H18N4S/c1-16-14(19)18-8-6-17(7-9-18)11-13-4-2-12(10-15)3-5-13/h2-5H,6-9,11H2,1H3,(H,16,19)