2-[5-bromanyl-4-(5-ethanoyl-6-phenyl-2-sulfanylidene-3,4-dihydro-1H-pyrimidin-4-yl)-2-ethoxy-phenoxy]-N-(2-methylphenyl)ethanamide

Systemtic Name: 2-[5-bromanyl-4-(5-ethanoyl-6-phenyl-2-sulfanylidene-3,4-dihydro-1H-pyrimidin-4-yl)-2-ethoxy-phenoxy]-N-(2-methylphenyl)ethanamide Openeye Name: 2-[4-(5-acetyl-6-phenyl-2-thioxo-3,4-dihydro-1H-pyrimidin-4-yl)-5-bromo-2-ethoxy-phenoxy]-N-(o-tolyl)acetamide CAS Name: 2-[4-(5-acetyl-6-phenyl-2-sulfanylidene-3,4-dihydro-1H-pyrimidin-4-yl)-5-bromo-2-ethoxyphenoxy]-N-(2-methylphenyl)acetamide IUPAC Name: 2-[4-(5-acetyl-6-phenyl-2-sulfanylidene-3,4-dihydro-1H-pyrimidin-4-yl)-5-bromo-2-ethoxyphenoxy]-N-(2-methylphenyl)acetamide Traditional Name: 2-[4-(5-acetyl-6-phenyl-2-thioxo-3,4-dihydro-1H-pyrimidin-4-yl)-5-bromo-2-ethoxy-phenoxy]-N-(o-tolyl)acetamide Formula: C29H28BrN3O4S MolecularWeight: 594.51932

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C=C(C(=C1)C2C(=C(NC(=S)N2)C3=CC=CC=C3)C(=O)C)Br)OCC(=O)NC4=CC=CC=C4C

Isomeric SMILES

CCOC1=C(C=C(C(=C1)C2C(=C(NC(=S)N2)C3=CC=CC=C3)C(=O)C)Br)OCC(=O)NC4=CC=CC=C4C

InChI

InChI=1S/C29H28BrN3O4S/c1-4-36-23-14-20(21(30)15-24(23)37-16-25(35)31-22-13-9-8-10-17(22)2)28-26(18(3)34)27(32-29(38)33-28)19-11-6-5-7-12-19/h5-15,28H,4,16H2,1-3H3,(H,31,35)(H2,32,33,38)