2-[(3-methoxyphenyl)methylsulfanyl]-3-prop-2-enyl-6-(trifluoromethyl)pyrimidin-4-one

Systemtic Name: 2-[(3-methoxyphenyl)methylsulfanyl]-3-prop-2-enyl-6-(trifluoromethyl)pyrimidin-4-one Openeye Name: 3-allyl-2-[(3-methoxyphenyl)methylsulfanyl]-6-(trifluoromethyl)pyrimidin-4-one CAS Name: 2-[(3-methoxyphenyl)methylthio]-3-prop-2-enyl-6-(trifluoromethyl)-4-pyrimidinone IUPAC Name: 2-[(3-methoxyphenyl)methylsulfanyl]-3-prop-2-enyl-6-(trifluoromethyl)pyrimidin-4-one Traditional Name: 3-allyl-2-(m-anisylthio)-6-(trifluoromethyl)pyrimidin-4-one Formula: C16H15F3N2O2S MolecularWeight: 356.36271

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC(=C1)CSC2=NC(=CC(=O)N2CC=C)C(F)(F)F

Isomeric SMILES

COC1=CC=CC(=C1)CSC2=NC(=CC(=O)N2CC=C)C(F)(F)F

InChI

InChI=1S/C16H15F3N2O2S/c1-3-7-21-14(22)9-13(16(17,18)19)20-15(21)24-10-11-5-4-6-12(8-11)23-2/h3-6,8-9H,1,7,10H2,2H3