2-(1,3-benzothiazol-2-ylmethylsulfanyl)-6-propyl-1H-pyrimidin-4-one

Systemtic Name: 2-(1,3-benzothiazol-2-ylmethylsulfanyl)-6-propyl-1H-pyrimidin-4-one Openeye Name: 2-(1,3-benzothiazol-2-ylmethylsulfanyl)-6-propyl-1H-pyrimidin-4-one CAS Name: 2-(1,3-benzothiazol-2-ylmethylthio)-6-propyl-1H-pyrimidin-4-one IUPAC Name: 2-(1,3-benzothiazol-2-ylmethylsulfanyl)-6-propyl-1H-pyrimidin-4-one Traditional Name: 2-(1,3-benzothiazol-2-ylmethylthio)-6-propyl-1H-pyrimidin-4-one Formula: C15H15N3OS2 MolecularWeight: 317.4291

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Descriptors Computed from Structure

Canonical SMILES:

CCCC1=CC(=O)N=C(N1)SCC2=NC3=CC=CC=C3S2

Isomeric SMILES

CCCC1=CC(=O)N=C(N1)SCC2=NC3=CC=CC=C3S2

InChI

InChI=1S/C15H15N3OS2/c1-2-5-10-8-13(19)18-15(16-10)20-9-14-17-11-6-3-4-7-12(11)21-14/h3-4,6-8H,2,5,9H2,1H3,(H,16,18,19)