N-methyl-4-(phenylmethyl)piperazine-1-carbothioamide

Systemtic Name: N-methyl-4-(phenylmethyl)piperazine-1-carbothioamide Openeye Name: 4-benzyl-N-methyl-piperazine-1-carbothioamide CAS Name: N-methyl-4-(phenylmethyl)-1-piperazinecarbothioamide IUPAC Name: 4-benzyl-N-methylpiperazine-1-carbothioamide Traditional Name: 4-benzyl-N-methyl-piperazine-1-carbothioamide Formula: C13H19N3S MolecularWeight: 249.37506

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C13H19N3S/c1-14-13(17)16-9-7-15(8-10-16)11-12-5-3-2-4-6-12/h2-6H,7-11H2,1H3,(H,14,17)