3-(2-pyridin-3-ylpiperidin-1-yl)carbonylisothiochromen-1-one

Systemtic Name: 3-(2-pyridin-3-ylpiperidin-1-yl)carbonylisothiochromen-1-one Openeye Name: 3-[2-(3-pyridyl)piperidine-1-carbonyl]isothiochromen-1-one CAS Name: 3-[oxo-[2-(3-pyridinyl)-1-piperidinyl]methyl]-2-benzothiopyran-1-one IUPAC Name: 3-(2-pyridin-3-ylpiperidine-1-carbonyl)isothiochromen-1-one Traditional Name: 3-[2-(3-pyridyl)piperidine-1-carbonyl]isothiochromen-1-one Formula: C20H18N2O2S MolecularWeight: 350.43412

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(C(C1)C2=CN=CC=C2)C(=O)C3=CC4=CC=CC=C4C(=O)S3

Isomeric SMILES

C1CCN(C(C1)C2=CN=CC=C2)C(=O)C3=CC4=CC=CC=C4C(=O)S3

InChI

InChI=1S/C20H18N2O2S/c23-19(18-12-14-6-1-2-8-16(14)20(24)25-18)22-11-4-3-9-17(22)15-7-5-10-21-13-15/h1-2,5-8,10,12-13,17H,3-4,9,11H2