2-butan-2-ylsulfanyl-6-(pyridin-3-ylmethyl)-1H-pyrimidin-4-one

Systemtic Name: 2-butan-2-ylsulfanyl-6-(pyridin-3-ylmethyl)-1H-pyrimidin-4-one Openeye Name: 6-(3-pyridylmethyl)-2-sec-butylsulfanyl-1H-pyrimidin-4-one CAS Name: 2-(butan-2-ylthio)-6-(3-pyridinylmethyl)-1H-pyrimidin-4-one IUPAC Name: 2-butan-2-ylsulfanyl-6-(pyridin-3-ylmethyl)-1H-pyrimidin-4-one Traditional Name: 6-(3-pyridylmethyl)-2-(sec-butylthio)-1H-pyrimidin-4-one Formula: C14H17N3OS MolecularWeight: 275.36928

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)SC1=NC(=O)C=C(N1)CC2=CN=CC=C2

Isomeric SMILES

CCC(C)SC1=NC(=O)C=C(N1)CC2=CN=CC=C2

InChI

InChI=1S/C14H17N3OS/c1-3-10(2)19-14-16-12(8-13(18)17-14)7-11-5-4-6-15-9-11/h4-6,8-10H,3,7H2,1-2H3,(H,16,17,18)