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

Systemtic Name: 2-[5-[(4-bromophenyl)methyl]-1,4-dimethyl-6-oxidanylidene-pyrimidin-2-yl]sulfanyl-N-(1,2-diphenylethyl)ethanamide Openeye Name: 2-[5-[(4-bromophenyl)methyl]-1,4-dimethyl-6-oxo-pyrimidin-2-yl]sulfanyl-N-(1,2-diphenylethyl)acetamide CAS Name: 2-[[5-[(4-bromophenyl)methyl]-1,4-dimethyl-6-oxo-2-pyrimidinyl]thio]-N-(1,2-diphenylethyl)acetamide IUPAC Name: 2-[5-[(4-bromophenyl)methyl]-1,4-dimethyl-6-oxopyrimidin-2-yl]sulfanyl-N-(1,2-diphenylethyl)acetamide Traditional Name: 2-[[5-(4-bromobenzyl)-6-keto-1,4-dimethyl-pyrimidin-2-yl]thio]-N-(1,2-diphenylethyl)acetamide Formula: C29H28BrN3O2S MolecularWeight: 562.52052

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=O)N(C(=N1)SCC(=O)NC(CC2=CC=CC=C2)C3=CC=CC=C3)C)CC4=CC=C(C=C4)Br

Isomeric SMILES

CC1=C(C(=O)N(C(=N1)SCC(=O)NC(CC2=CC=CC=C2)C3=CC=CC=C3)C)CC4=CC=C(C=C4)Br

InChI

InChI=1S/C29H28BrN3O2S/c1-20-25(17-22-13-15-24(30)16-14-22)28(35)33(2)29(31-20)36-19-27(34)32-26(23-11-7-4-8-12-23)18-21-9-5-3-6-10-21/h3-16,26H,17-19H2,1-2H3,(H,32,34)