[4-[2-(4-chloranylphenoxy)ethyl]piperazin-1-yl]-(2-sulfanylidene-1H-pyridin-3-yl)methanone

Systemtic Name: [4-[2-(4-chloranylphenoxy)ethyl]piperazin-1-yl]-(2-sulfanylidene-1H-pyridin-3-yl)methanone Openeye Name: [4-[2-(4-chlorophenoxy)ethyl]piperazin-1-yl]-(2-thioxo-1H-pyridin-3-yl)methanone CAS Name: [4-[2-(4-chlorophenoxy)ethyl]-1-piperazinyl]-(2-sulfanylidene-1H-pyridin-3-yl)methanone IUPAC Name: [4-[2-(4-chlorophenoxy)ethyl]piperazin-1-yl]-(2-sulfanylidene-1H-pyridin-3-yl)methanone Traditional Name: [4-[2-(4-chlorophenoxy)ethyl]piperazino]-(2-thioxo-1H-pyridin-3-yl)methanone Formula: C18H20ClN3O2S MolecularWeight: 377.8883

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1CCOC2=CC=C(C=C2)Cl)C(=O)C3=CC=CNC3=S

Isomeric SMILES

C1CN(CCN1CCOC2=CC=C(C=C2)Cl)C(=O)C3=CC=CNC3=S

InChI

InChI=1S/C18H20ClN3O2S/c19-14-3-5-15(6-4-14)24-13-12-21-8-10-22(11-9-21)18(23)16-2-1-7-20-17(16)25/h1-7H,8-13H2,(H,20,25)