2-[5-[(4-bromophenyl)methyl]-1,4-dimethyl-6-oxidanylidene-pyrimidin-2-yl]sulfanyl-N-(2-fluorophenyl)ethanamide

Systemtic Name: 2-[5-[(4-bromophenyl)methyl]-1,4-dimethyl-6-oxidanylidene-pyrimidin-2-yl]sulfanyl-N-(2-fluorophenyl)ethanamide Openeye Name: 2-[5-[(4-bromophenyl)methyl]-1,4-dimethyl-6-oxo-pyrimidin-2-yl]sulfanyl-N-(2-fluorophenyl)acetamide CAS Name: 2-[[5-[(4-bromophenyl)methyl]-1,4-dimethyl-6-oxo-2-pyrimidinyl]thio]-N-(2-fluorophenyl)acetamide IUPAC Name: 2-[5-[(4-bromophenyl)methyl]-1,4-dimethyl-6-oxopyrimidin-2-yl]sulfanyl-N-(2-fluorophenyl)acetamide Traditional Name: 2-[[5-(4-bromobenzyl)-6-keto-1,4-dimethyl-pyrimidin-2-yl]thio]-N-(2-fluorophenyl)acetamide Formula: C21H19BrFN3O2S MolecularWeight: 476.361863

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=O)N(C(=N1)SCC(=O)NC2=CC=CC=C2F)C)CC3=CC=C(C=C3)Br

Isomeric SMILES

CC1=C(C(=O)N(C(=N1)SCC(=O)NC2=CC=CC=C2F)C)CC3=CC=C(C=C3)Br

InChI

InChI=1S/C21H19BrFN3O2S/c1-13-16(11-14-7-9-15(22)10-8-14)20(28)26(2)21(24-13)29-12-19(27)25-18-6-4-3-5-17(18)23/h3-10H,11-12H2,1-2H3,(H,25,27)