5-propan-2-yl-2-prop-2-enylsulfanyl-6-(thiophen-2-ylmethyl)-1H-pyrimidin-4-one

Systemtic Name: 5-propan-2-yl-2-prop-2-enylsulfanyl-6-(thiophen-2-ylmethyl)-1H-pyrimidin-4-one Openeye Name: 2-allylsulfanyl-5-isopropyl-6-(2-thienylmethyl)-1H-pyrimidin-4-one CAS Name: 5-propan-2-yl-2-(prop-2-enylthio)-6-(thiophen-2-ylmethyl)-1H-pyrimidin-4-one IUPAC Name: 5-propan-2-yl-2-prop-2-enylsulfanyl-6-(thiophen-2-ylmethyl)-1H-pyrimidin-4-one Traditional Name: 2-(allylthio)-5-isopropyl-6-(2-thenyl)-1H-pyrimidin-4-one Formula: C15H18N2OS2 MolecularWeight: 306.44622

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C1=C(NC(=NC1=O)SCC=C)CC2=CC=CS2

Isomeric SMILES

CC(C)C1=C(NC(=NC1=O)SCC=C)CC2=CC=CS2

InChI

InChI=1S/C15H18N2OS2/c1-4-7-20-15-16-12(9-11-6-5-8-19-11)13(10(2)3)14(18)17-15/h4-6,8,10H,1,7,9H2,2-3H3,(H,16,17,18)