2-[4-ethanoyl-2-(pyrimidin-2-ylsulfanylmethyl)phenoxy]-N-(3-phenylpropyl)ethanamide

Systemtic Name: 2-[4-ethanoyl-2-(pyrimidin-2-ylsulfanylmethyl)phenoxy]-N-(3-phenylpropyl)ethanamide Openeye Name: 2-[4-acetyl-2-(pyrimidin-2-ylsulfanylmethyl)phenoxy]-N-(3-phenylpropyl)acetamide CAS Name: 2-[4-acetyl-2-[(2-pyrimidinylthio)methyl]phenoxy]-N-(3-phenylpropyl)acetamide IUPAC Name: 2-[4-acetyl-2-(pyrimidin-2-ylsulfanylmethyl)phenoxy]-N-(3-phenylpropyl)acetamide Traditional Name: 2-[4-acetyl-2-[(2-pyrimidylthio)methyl]phenoxy]-N-(3-phenylpropyl)acetamide Formula: C24H25N3O3S MolecularWeight: 435.5386

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)C1=CC(=C(C=C1)OCC(=O)NCCCC2=CC=CC=C2)CSC3=NC=CC=N3

Isomeric SMILES

CC(=O)C1=CC(=C(C=C1)OCC(=O)NCCCC2=CC=CC=C2)CSC3=NC=CC=N3

InChI

InChI=1S/C24H25N3O3S/c1-18(28)20-10-11-22(21(15-20)17-31-24-26-13-6-14-27-24)30-16-23(29)25-12-5-9-19-7-3-2-4-8-19/h2-4,6-8,10-11,13-15H,5,9,12,16-17H2,1H3,(H,25,29)