N-(3-bromanyl-4-methoxy-phenyl)-2-(4-methyl-6-oxidanylidene-1-phenyl-pyrimidin-2-yl)sulfanyl-ethanamide

Systemtic Name: N-(3-bromanyl-4-methoxy-phenyl)-2-(4-methyl-6-oxidanylidene-1-phenyl-pyrimidin-2-yl)sulfanyl-ethanamide Openeye Name: N-(3-bromo-4-methoxy-phenyl)-2-(4-methyl-6-oxo-1-phenyl-pyrimidin-2-yl)sulfanyl-acetamide CAS Name: N-(3-bromo-4-methoxyphenyl)-2-[(4-methyl-6-oxo-1-phenyl-2-pyrimidinyl)thio]acetamide IUPAC Name: N-(3-bromo-4-methoxyphenyl)-2-(4-methyl-6-oxo-1-phenylpyrimidin-2-yl)sulfanylacetamide Traditional Name: N-(3-bromo-4-methoxy-phenyl)-2-[(6-keto-4-methyl-1-phenyl-pyrimidin-2-yl)thio]acetamide Formula: C20H18BrN3O3S MolecularWeight: 460.34422

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=O)N(C(=N1)SCC(=O)NC2=CC(=C(C=C2)OC)Br)C3=CC=CC=C3

Isomeric SMILES

CC1=CC(=O)N(C(=N1)SCC(=O)NC2=CC(=C(C=C2)OC)Br)C3=CC=CC=C3

InChI

InChI=1S/C20H18BrN3O3S/c1-13-10-19(26)24(15-6-4-3-5-7-15)20(22-13)28-12-18(25)23-14-8-9-17(27-2)16(21)11-14/h3-11H,12H2,1-2H3,(H,23,25)