2-[4-ethanoyl-2-(pyrimidin-2-ylsulfanylmethyl)phenoxy]-N-[2-(4-methylphenoxy)phenyl]ethanamide

Systemtic Name: 2-[4-ethanoyl-2-(pyrimidin-2-ylsulfanylmethyl)phenoxy]-N-[2-(4-methylphenoxy)phenyl]ethanamide Openeye Name: 2-[4-acetyl-2-(pyrimidin-2-ylsulfanylmethyl)phenoxy]-N-[2-(4-methylphenoxy)phenyl]acetamide CAS Name: 2-[4-acetyl-2-[(2-pyrimidinylthio)methyl]phenoxy]-N-[2-(4-methylphenoxy)phenyl]acetamide IUPAC Name: 2-[4-acetyl-2-(pyrimidin-2-ylsulfanylmethyl)phenoxy]-N-[2-(4-methylphenoxy)phenyl]acetamide Traditional Name: 2-[4-acetyl-2-[(2-pyrimidylthio)methyl]phenoxy]-N-[2-(4-methylphenoxy)phenyl]acetamide Formula: C28H25N3O4S MolecularWeight: 499.5808

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)OC2=CC=CC=C2NC(=O)COC3=C(C=C(C=C3)C(=O)C)CSC4=NC=CC=N4

Isomeric SMILES

CC1=CC=C(C=C1)OC2=CC=CC=C2NC(=O)COC3=C(C=C(C=C3)C(=O)C)CSC4=NC=CC=N4

InChI

InChI=1S/C28H25N3O4S/c1-19-8-11-23(12-9-19)35-26-7-4-3-6-24(26)31-27(33)17-34-25-13-10-21(20(2)32)16-22(25)18-36-28-29-14-5-15-30-28/h3-16H,17-18H2,1-2H3,(H,31,33)