2-(6-oxidanylidene-2-phenethylsulfanyl-4-phenyl-pyrimidin-1-yl)-N-(4-phenoxyphenyl)ethanamide

Systemtic Name: 2-(6-oxidanylidene-2-phenethylsulfanyl-4-phenyl-pyrimidin-1-yl)-N-(4-phenoxyphenyl)ethanamide Openeye Name: 2-(6-oxo-2-phenethylsulfanyl-4-phenyl-pyrimidin-1-yl)-N-(4-phenoxyphenyl)acetamide CAS Name: 2-[6-oxo-2-(phenethylthio)-4-phenyl-1-pyrimidinyl]-N-(4-phenoxyphenyl)acetamide IUPAC Name: 2-(6-oxo-2-phenethylsulfanyl-4-phenylpyrimidin-1-yl)-N-(4-phenoxyphenyl)acetamide Traditional Name: 2-[6-keto-2-(phenethylthio)-4-phenyl-pyrimidin-1-yl]-N-(4-phenoxyphenyl)acetamide Formula: C32H27N3O3S MolecularWeight: 533.64008

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CCSC2=NC(=CC(=O)N2CC(=O)NC3=CC=C(C=C3)OC4=CC=CC=C4)C5=CC=CC=C5

Isomeric SMILES

C1=CC=C(C=C1)CCSC2=NC(=CC(=O)N2CC(=O)NC3=CC=C(C=C3)OC4=CC=CC=C4)C5=CC=CC=C5

InChI

InChI=1S/C32H27N3O3S/c36-30(33-26-16-18-28(19-17-26)38-27-14-8-3-9-15-27)23-35-31(37)22-29(25-12-6-2-7-13-25)34-32(35)39-21-20-24-10-4-1-5-11-24/h1-19,22H,20-21,23H2,(H,33,36)