6-(1,3-benzothiazol-2-ylsulfanylmethyl)-2-piperidin-1-yl-1H-pyrimidin-4-one

Systemtic Name: 6-(1,3-benzothiazol-2-ylsulfanylmethyl)-2-piperidin-1-yl-1H-pyrimidin-4-one Openeye Name: 6-(1,3-benzothiazol-2-ylsulfanylmethyl)-2-(1-piperidyl)-1H-pyrimidin-4-one CAS Name: 6-[(1,3-benzothiazol-2-ylthio)methyl]-2-(1-piperidinyl)-1H-pyrimidin-4-one IUPAC Name: 6-(1,3-benzothiazol-2-ylsulfanylmethyl)-2-piperidin-1-yl-1H-pyrimidin-4-one Traditional Name: 6-[(1,3-benzothiazol-2-ylthio)methyl]-2-piperidino-1H-pyrimidin-4-one Formula: C17H18N4OS2 MolecularWeight: 358.48102

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(CC1)C2=NC(=O)C=C(N2)CSC3=NC4=CC=CC=C4S3

Isomeric SMILES

C1CCN(CC1)C2=NC(=O)C=C(N2)CSC3=NC4=CC=CC=C4S3

InChI

InChI=1S/C17H18N4OS2/c22-15-10-12(18-16(20-15)21-8-4-1-5-9-21)11-23-17-19-13-6-2-3-7-14(13)24-17/h2-3,6-7,10H,1,4-5,8-9,11H2,(H,18,20,22)