N-(phenylmethyl)-4-(pyridin-4-ylmethyl)piperazine-1-carbothioamide

Systemtic Name: N-(phenylmethyl)-4-(pyridin-4-ylmethyl)piperazine-1-carbothioamide Openeye Name: N-benzyl-4-(4-pyridylmethyl)piperazine-1-carbothioamide CAS Name: N-(phenylmethyl)-4-(pyridin-4-ylmethyl)-1-piperazinecarbothioamide IUPAC Name: N-benzyl-4-(pyridin-4-ylmethyl)piperazine-1-carbothioamide Traditional Name: N-benzyl-4-(4-pyridylmethyl)piperazine-1-carbothioamide Formula: C18H22N4S MolecularWeight: 326.45908

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1CC2=CC=NC=C2)C(=S)NCC3=CC=CC=C3

Isomeric SMILES

C1CN(CCN1CC2=CC=NC=C2)C(=S)NCC3=CC=CC=C3

InChI

InChI=1S/C18H22N4S/c23-18(20-14-16-4-2-1-3-5-16)22-12-10-21(11-13-22)15-17-6-8-19-9-7-17/h1-9H,10-15H2,(H,20,23)