2-(6-oxidanyl-4-oxidanylidene-1-propyl-pyrimidin-2-yl)sulfanyl-N-phenethyl-ethanamide

Systemtic Name: 2-(6-oxidanyl-4-oxidanylidene-1-propyl-pyrimidin-2-yl)sulfanyl-N-phenethyl-ethanamide Openeye Name: 2-(6-hydroxy-4-oxo-1-propyl-pyrimidin-2-yl)sulfanyl-N-phenethyl-acetamide CAS Name: 2-[(6-hydroxy-4-oxo-1-propyl-2-pyrimidinyl)thio]-N-phenethylacetamide IUPAC Name: 2-(6-hydroxy-4-oxo-1-propylpyrimidin-2-yl)sulfanyl-N-phenethylacetamide Traditional Name: 2-[(6-hydroxy-4-keto-1-propyl-pyrimidin-2-yl)thio]-N-phenethyl-acetamide Formula: C17H21N3O3S MolecularWeight: 347.43194

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Descriptors Computed from Structure

Canonical SMILES:

CCCN1C(=CC(=O)N=C1SCC(=O)NCCC2=CC=CC=C2)O

Isomeric SMILES

CCCN1C(=CC(=O)N=C1SCC(=O)NCCC2=CC=CC=C2)O

InChI

InChI=1S/C17H21N3O3S/c1-2-10-20-16(23)11-14(21)19-17(20)24-12-15(22)18-9-8-13-6-4-3-5-7-13/h3-7,11,23H,2,8-10,12H2,1H3,(H,18,22)