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

Systemtic Name: 6-[(2-bromophenyl)methyl]-5-ethyl-2-[2-(4-methoxyphenyl)-2-oxidanylidene-ethyl]sulfanyl-1H-pyrimidin-4-one Openeye Name: 6-[(2-bromophenyl)methyl]-5-ethyl-2-[2-(4-methoxyphenyl)-2-oxo-ethyl]sulfanyl-1H-pyrimidin-4-one CAS Name: 6-[(2-bromophenyl)methyl]-5-ethyl-2-[[2-(4-methoxyphenyl)-2-oxoethyl]thio]-1H-pyrimidin-4-one IUPAC Name: 6-[(2-bromophenyl)methyl]-5-ethyl-2-[2-(4-methoxyphenyl)-2-oxoethyl]sulfanyl-1H-pyrimidin-4-one Traditional Name: 6-(2-bromobenzyl)-5-ethyl-2-[[2-keto-2-(4-methoxyphenyl)ethyl]thio]-1H-pyrimidin-4-one Formula: C22H21BrN2O3S MolecularWeight: 473.38274

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=C(NC(=NC1=O)SCC(=O)C2=CC=C(C=C2)OC)CC3=CC=CC=C3Br

Isomeric SMILES

CCC1=C(NC(=NC1=O)SCC(=O)C2=CC=C(C=C2)OC)CC3=CC=CC=C3Br

InChI

InChI=1S/C22H21BrN2O3S/c1-3-17-19(12-15-6-4-5-7-18(15)23)24-22(25-21(17)27)29-13-20(26)14-8-10-16(28-2)11-9-14/h4-11H,3,12-13H2,1-2H3,(H,24,25,27)