6-[(3S)-1-(6-chloranyl-1,3-benzothiazol-2-yl)piperidin-3-yl]-1H-pyrimidin-4-one

Systemtic Name: 6-[(3S)-1-(6-chloranyl-1,3-benzothiazol-2-yl)piperidin-3-yl]-1H-pyrimidin-4-one Openeye Name: 6-[(3S)-1-(6-chloro-1,3-benzothiazol-2-yl)-3-piperidyl]-1H-pyrimidin-4-one CAS Name: 6-[(3S)-1-(6-chloro-1,3-benzothiazol-2-yl)-3-piperidinyl]-1H-pyrimidin-4-one IUPAC Name: 6-[(3S)-1-(6-chloro-1,3-benzothiazol-2-yl)piperidin-3-yl]-1H-pyrimidin-4-one Traditional Name: 6-[(3S)-1-(6-chloro-1,3-benzothiazol-2-yl)-3-piperidyl]-1H-pyrimidin-4-one Formula: C16H15ClN4OS MolecularWeight: 346.8345

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(CN(C1)C2=NC3=C(S2)C=C(C=C3)Cl)C4=CC(=O)N=CN4

Isomeric SMILES

C1C[C@@H](CN(C1)C2=NC3=C(S2)C=C(C=C3)Cl)C4=CC(=O)N=CN4

InChI

InChI=1S/C16H15ClN4OS/c17-11-3-4-12-14(6-11)23-16(20-12)21-5-1-2-10(8-21)13-7-15(22)19-9-18-13/h3-4,6-7,9-10H,1-2,5,8H2,(H,18,19,22)/t10-/m0/s1