6-methyl-2-[2-oxidanylidene-2-(4-propylphenyl)ethyl]sulfanyl-1H-pyrimidin-4-one

Systemtic Name: 6-methyl-2-[2-oxidanylidene-2-(4-propylphenyl)ethyl]sulfanyl-1H-pyrimidin-4-one Openeye Name: 6-methyl-2-[2-oxo-2-(4-propylphenyl)ethyl]sulfanyl-1H-pyrimidin-4-one CAS Name: 6-methyl-2-[[2-oxo-2-(4-propylphenyl)ethyl]thio]-1H-pyrimidin-4-one IUPAC Name: 6-methyl-2-[2-oxo-2-(4-propylphenyl)ethyl]sulfanyl-1H-pyrimidin-4-one Traditional Name: 2-[[2-keto-2-(4-propylphenyl)ethyl]thio]-6-methyl-1H-pyrimidin-4-one Formula: C16H18N2O2S MolecularWeight: 302.39132

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Descriptors Computed from Structure

Canonical SMILES:

CCCC1=CC=C(C=C1)C(=O)CSC2=NC(=O)C=C(N2)C

Isomeric SMILES

CCCC1=CC=C(C=C1)C(=O)CSC2=NC(=O)C=C(N2)C

InChI

InChI=1S/C16H18N2O2S/c1-3-4-12-5-7-13(8-6-12)14(19)10-21-16-17-11(2)9-15(20)18-16/h5-9H,3-4,10H2,1-2H3,(H,17,18,20)