2-chloranyl-N-[4-(pyridin-4-ylmethyl)piperazin-1-yl]carbothioyl-benzamide

Systemtic Name: 2-chloranyl-N-[4-(pyridin-4-ylmethyl)piperazin-1-yl]carbothioyl-benzamide Openeye Name: 2-chloro-N-[4-(4-pyridylmethyl)piperazine-1-carbothioyl]benzamide CAS Name: 2-chloro-N-[[4-(pyridin-4-ylmethyl)-1-piperazinyl]-sulfanylidenemethyl]benzamide IUPAC Name: 2-chloro-N-[4-(pyridin-4-ylmethyl)piperazine-1-carbothioyl]benzamide Traditional Name: 2-chloro-N-[4-(4-pyridylmethyl)piperazine-1-carbothioyl]benzamide Formula: C18H19ClN4OS MolecularWeight: 374.88766

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1CC2=CC=NC=C2)C(=S)NC(=O)C3=CC=CC=C3Cl

Isomeric SMILES

C1CN(CCN1CC2=CC=NC=C2)C(=S)NC(=O)C3=CC=CC=C3Cl

InChI

InChI=1S/C18H19ClN4OS/c19-16-4-2-1-3-15(16)17(24)21-18(25)23-11-9-22(10-12-23)13-14-5-7-20-8-6-14/h1-8H,9-13H2,(H,21,24,25)