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

Systemtic Name: 6-[(2-bromophenyl)methyl]-2-[2-(4-methoxyphenyl)-2-oxidanylidene-ethyl]sulfanyl-5-methyl-1H-pyrimidin-4-one Openeye Name: 6-[(2-bromophenyl)methyl]-2-[2-(4-methoxyphenyl)-2-oxo-ethyl]sulfanyl-5-methyl-1H-pyrimidin-4-one CAS Name: 6-[(2-bromophenyl)methyl]-2-[[2-(4-methoxyphenyl)-2-oxoethyl]thio]-5-methyl-1H-pyrimidin-4-one IUPAC Name: 6-[(2-bromophenyl)methyl]-2-[2-(4-methoxyphenyl)-2-oxoethyl]sulfanyl-5-methyl-1H-pyrimidin-4-one Traditional Name: 6-(2-bromobenzyl)-2-[[2-keto-2-(4-methoxyphenyl)ethyl]thio]-5-methyl-1H-pyrimidin-4-one Formula: C21H19BrN2O3S MolecularWeight: 459.35616

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(NC(=NC1=O)SCC(=O)C2=CC=C(C=C2)OC)CC3=CC=CC=C3Br

Isomeric SMILES

CC1=C(NC(=NC1=O)SCC(=O)C2=CC=C(C=C2)OC)CC3=CC=CC=C3Br

InChI

InChI=1S/C21H19BrN2O3S/c1-13-18(11-15-5-3-4-6-17(15)22)23-21(24-20(13)26)28-12-19(25)14-7-9-16(27-2)10-8-14/h3-10H,11-12H2,1-2H3,(H,23,24,26)