2-[1-(3-chlorophenyl)imidazol-2-yl]sulfanyl-1-(4-pyridin-4-ylpiperazin-1-yl)ethanone

Systemtic Name: 2-[1-(3-chlorophenyl)imidazol-2-yl]sulfanyl-1-(4-pyridin-4-ylpiperazin-1-yl)ethanone Openeye Name: 2-[1-(3-chlorophenyl)imidazol-2-yl]sulfanyl-1-[4-(4-pyridyl)piperazin-1-yl]ethanone CAS Name: 2-[[1-(3-chlorophenyl)-2-imidazolyl]thio]-1-(4-pyridin-4-yl-1-piperazinyl)ethanone IUPAC Name: 2-[1-(3-chlorophenyl)imidazol-2-yl]sulfanyl-1-(4-pyridin-4-ylpiperazin-1-yl)ethanone Traditional Name: 2-[[1-(3-chlorophenyl)imidazol-2-yl]thio]-1-[4-(4-pyridyl)piperazino]ethanone Formula: C20H20ClN5OS MolecularWeight: 413.9237

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1C2=CC=NC=C2)C(=O)CSC3=NC=CN3C4=CC(=CC=C4)Cl

Isomeric SMILES

C1CN(CCN1C2=CC=NC=C2)C(=O)CSC3=NC=CN3C4=CC(=CC=C4)Cl

InChI

InChI=1S/C20H20ClN5OS/c21-16-2-1-3-18(14-16)26-9-8-23-20(26)28-15-19(27)25-12-10-24(11-13-25)17-4-6-22-7-5-17/h1-9,14H,10-13,15H2