N-(4-bromanyl-2-methyl-phenyl)-2-[2-[(3-chlorophenyl)methylsulfanyl]-6-methyl-4-oxidanylidene-1H-pyrimidin-5-yl]ethanamide

Systemtic Name: N-(4-bromanyl-2-methyl-phenyl)-2-[2-[(3-chlorophenyl)methylsulfanyl]-6-methyl-4-oxidanylidene-1H-pyrimidin-5-yl]ethanamide Openeye Name: N-(4-bromo-2-methyl-phenyl)-2-[2-[(3-chlorophenyl)methylsulfanyl]-6-methyl-4-oxo-1H-pyrimidin-5-yl]acetamide CAS Name: N-(4-bromo-2-methylphenyl)-2-[2-[(3-chlorophenyl)methylthio]-6-methyl-4-oxo-1H-pyrimidin-5-yl]acetamide IUPAC Name: N-(4-bromo-2-methylphenyl)-2-[2-[(3-chlorophenyl)methylsulfanyl]-6-methyl-4-oxo-1H-pyrimidin-5-yl]acetamide Traditional Name: N-(4-bromo-2-methyl-phenyl)-2-[2-[(3-chlorobenzyl)thio]-4-keto-6-methyl-1H-pyrimidin-5-yl]acetamide Formula: C21H19BrClN3O2S MolecularWeight: 492.81646

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1)Br)NC(=O)CC2=C(NC(=NC2=O)SCC3=CC(=CC=C3)Cl)C

Isomeric SMILES

CC1=C(C=CC(=C1)Br)NC(=O)CC2=C(NC(=NC2=O)SCC3=CC(=CC=C3)Cl)C

InChI

InChI=1S/C21H19BrClN3O2S/c1-12-8-15(22)6-7-18(12)25-19(27)10-17-13(2)24-21(26-20(17)28)29-11-14-4-3-5-16(23)9-14/h3-9H,10-11H2,1-2H3,(H,25,27)(H,24,26,28)