2-[2-(4-bromophenyl)-2-oxidanylidene-ethyl]sulfanyl-5-ethyl-6-methyl-1H-pyrimidin-4-one

Systemtic Name: 2-[2-(4-bromophenyl)-2-oxidanylidene-ethyl]sulfanyl-5-ethyl-6-methyl-1H-pyrimidin-4-one Openeye Name: 2-[2-(4-bromophenyl)-2-oxo-ethyl]sulfanyl-5-ethyl-6-methyl-1H-pyrimidin-4-one CAS Name: 2-[[2-(4-bromophenyl)-2-oxoethyl]thio]-5-ethyl-6-methyl-1H-pyrimidin-4-one IUPAC Name: 2-[2-(4-bromophenyl)-2-oxoethyl]sulfanyl-5-ethyl-6-methyl-1H-pyrimidin-4-one Traditional Name: 2-[[2-(4-bromophenyl)-2-keto-ethyl]thio]-5-ethyl-6-methyl-1H-pyrimidin-4-one Formula: C15H15BrN2O2S MolecularWeight: 367.2608

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=C(NC(=NC1=O)SCC(=O)C2=CC=C(C=C2)Br)C

Isomeric SMILES

CCC1=C(NC(=NC1=O)SCC(=O)C2=CC=C(C=C2)Br)C

InChI

InChI=1S/C15H15BrN2O2S/c1-3-12-9(2)17-15(18-14(12)20)21-8-13(19)10-4-6-11(16)7-5-10/h4-7H,3,8H2,1-2H3,(H,17,18,20)