3-[4-[[5-(3-chlorophenyl)thiophen-2-yl]methyl]piperazin-1-yl]carbonyl-1H-pyridin-2-one

Systemtic Name: 3-[4-[[5-(3-chlorophenyl)thiophen-2-yl]methyl]piperazin-1-yl]carbonyl-1H-pyridin-2-one Openeye Name: 3-[4-[[5-(3-chlorophenyl)-2-thienyl]methyl]piperazine-1-carbonyl]-1H-pyridin-2-one CAS Name: 3-[[4-[[5-(3-chlorophenyl)-2-thiophenyl]methyl]-1-piperazinyl]-oxomethyl]-1H-pyridin-2-one IUPAC Name: 3-[4-[[5-(3-chlorophenyl)thiophen-2-yl]methyl]piperazine-1-carbonyl]-1H-pyridin-2-one Traditional Name: 3-[4-[[5-(3-chlorophenyl)-2-thienyl]methyl]piperazine-1-carbonyl]-2-pyridone Formula: C21H20ClN3O2S MolecularWeight: 413.9204

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1CC2=CC=C(S2)C3=CC(=CC=C3)Cl)C(=O)C4=CC=CNC4=O

Isomeric SMILES

C1CN(CCN1CC2=CC=C(S2)C3=CC(=CC=C3)Cl)C(=O)C4=CC=CNC4=O

InChI

InChI=1S/C21H20ClN3O2S/c22-16-4-1-3-15(13-16)19-7-6-17(28-19)14-24-9-11-25(12-10-24)21(27)18-5-2-8-23-20(18)26/h1-8,13H,9-12,14H2,(H,23,26)