8-chloranyl-2-[(3-oxidanylpiperidin-1-yl)methyl]-1H-[1]benzothiolo[3,2-d]pyrimidin-4-one

Systemtic Name: 8-chloranyl-2-[(3-oxidanylpiperidin-1-yl)methyl]-1H-[1]benzothiolo[3,2-d]pyrimidin-4-one Openeye Name: 8-chloro-2-[(3-hydroxy-1-piperidyl)methyl]-1H-benzothiopheno[3,2-d]pyrimidin-4-one CAS Name: 8-chloro-2-[(3-hydroxy-1-piperidinyl)methyl]-1H-[1]benzothiolo[3,2-d]pyrimidin-4-one IUPAC Name: 8-chloro-2-[(3-hydroxypiperidin-1-yl)methyl]-1H-[1]benzothiolo[3,2-d]pyrimidin-4-one Traditional Name: 8-chloro-2-[(3-hydroxypiperidino)methyl]-1H-benzothiopheno[3,2-d]pyrimidin-4-one Formula: C16H16ClN3O2S MolecularWeight: 349.83514

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(CN(C1)CC2=NC(=O)C3=C(N2)C4=C(S3)C=CC(=C4)Cl)O

Isomeric SMILES

C1CC(CN(C1)CC2=NC(=O)C3=C(N2)C4=C(S3)C=CC(=C4)Cl)O

InChI

InChI=1S/C16H16ClN3O2S/c17-9-3-4-12-11(6-9)14-15(23-12)16(22)19-13(18-14)8-20-5-1-2-10(21)7-20/h3-4,6,10,21H,1-2,5,7-8H2,(H,18,19,22)