[4-[(4-chlorophenyl)methyl]piperazin-1-yl]-(2-sulfanylidene-1H-pyridin-3-yl)methanone

Systemtic Name: [4-[(4-chlorophenyl)methyl]piperazin-1-yl]-(2-sulfanylidene-1H-pyridin-3-yl)methanone Openeye Name: [4-[(4-chlorophenyl)methyl]piperazin-1-yl]-(2-thioxo-1H-pyridin-3-yl)methanone CAS Name: [4-[(4-chlorophenyl)methyl]-1-piperazinyl]-(2-sulfanylidene-1H-pyridin-3-yl)methanone IUPAC Name: [4-[(4-chlorophenyl)methyl]piperazin-1-yl]-(2-sulfanylidene-1H-pyridin-3-yl)methanone Traditional Name: [4-(4-chlorobenzyl)piperazino]-(2-thioxo-1H-pyridin-3-yl)methanone Formula: C17H18ClN3OS MolecularWeight: 347.86232

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1CC2=CC=C(C=C2)Cl)C(=O)C3=CC=CNC3=S

Isomeric SMILES

C1CN(CCN1CC2=CC=C(C=C2)Cl)C(=O)C3=CC=CNC3=S

InChI

InChI=1S/C17H18ClN3OS/c18-14-5-3-13(4-6-14)12-20-8-10-21(11-9-20)17(22)15-2-1-7-19-16(15)23/h1-7H,8-12H2,(H,19,23)