2-[1-[3,5-bis(fluoranyl)phenyl]carbonylpiperidin-3-yl]-5,6,7,8-tetrahydro-3H-[1]benzothiolo[2,3-d]pyrimidin-4-one

Systemtic Name: 2-[1-[3,5-bis(fluoranyl)phenyl]carbonylpiperidin-3-yl]-5,6,7,8-tetrahydro-3H-[1]benzothiolo[2,3-d]pyrimidin-4-one Openeye Name: 2-[1-(3,5-difluorobenzoyl)-3-piperidyl]-5,6,7,8-tetrahydro-3H-benzothiopheno[2,3-d]pyrimidin-4-one CAS Name: 2-[1-[(3,5-difluorophenyl)-oxomethyl]-3-piperidinyl]-5,6,7,8-tetrahydro-3H-[1]benzothiolo[2,3-d]pyrimidin-4-one IUPAC Name: 2-[1-(3,5-difluorobenzoyl)piperidin-3-yl]-5,6,7,8-tetrahydro-3H-[1]benzothiolo[2,3-d]pyrimidin-4-one Traditional Name: 2-[1-(3,5-difluorobenzoyl)-3-piperidyl]-5,6,7,8-tetrahydro-3H-benzothiopheno[2,3-d]pyrimidin-4-one Formula: C22H21F2N3O2S MolecularWeight: 429.482846

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC2=C(C1)C3=C(S2)N=C(NC3=O)C4CCCN(C4)C(=O)C5=CC(=CC(=C5)F)F

Isomeric SMILES

C1CCC2=C(C1)C3=C(S2)N=C(NC3=O)C4CCCN(C4)C(=O)C5=CC(=CC(=C5)F)F

InChI

InChI=1S/C22H21F2N3O2S/c23-14-8-13(9-15(24)10-14)22(29)27-7-3-4-12(11-27)19-25-20(28)18-16-5-1-2-6-17(16)30-21(18)26-19/h8-10,12H,1-7,11H2,(H,25,26,28)