3-chloranyl-N-(4-methanoylpiperazin-1-yl)carbothioyl-benzamide

Systemtic Name: 3-chloranyl-N-(4-methanoylpiperazin-1-yl)carbothioyl-benzamide Openeye Name: 3-chloro-N-(4-formylpiperazine-1-carbothioyl)benzamide CAS Name: 3-chloro-N-[(4-formyl-1-piperazinyl)-sulfanylidenemethyl]benzamide IUPAC Name: 3-chloro-N-(4-formylpiperazine-1-carbothioyl)benzamide Traditional Name: 3-chloro-N-(4-formylpiperazine-1-carbothioyl)benzamide Formula: C13H14ClN3O2S MolecularWeight: 311.78716

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1C=O)C(=S)NC(=O)C2=CC(=CC=C2)Cl

Isomeric SMILES

C1CN(CCN1C=O)C(=S)NC(=O)C2=CC(=CC=C2)Cl

InChI

InChI=1S/C13H14ClN3O2S/c14-11-3-1-2-10(8-11)12(19)15-13(20)17-6-4-16(9-18)5-7-17/h1-3,8-9H,4-7H2,(H,15,19,20)