2-[(5-ethyl-4-oxidanyl-6-oxidanylidene-1H-pyrimidin-2-yl)sulfanyl]-N-phenethyl-ethanamide

Systemtic Name: 2-[(5-ethyl-4-oxidanyl-6-oxidanylidene-1H-pyrimidin-2-yl)sulfanyl]-N-phenethyl-ethanamide Openeye Name: 2-[(5-ethyl-4-hydroxy-6-oxo-1H-pyrimidin-2-yl)sulfanyl]-N-phenethyl-acetamide CAS Name: 2-[(5-ethyl-4-hydroxy-6-oxo-1H-pyrimidin-2-yl)thio]-N-phenethylacetamide IUPAC Name: 2-[(5-ethyl-4-hydroxy-6-oxo-1H-pyrimidin-2-yl)sulfanyl]-N-phenethylacetamide Traditional Name: 2-[(5-ethyl-4-hydroxy-6-keto-1H-pyrimidin-2-yl)thio]-N-phenethyl-acetamide Formula: C16H19N3O3S MolecularWeight: 333.40536

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=C(N=C(NC1=O)SCC(=O)NCCC2=CC=CC=C2)O

Isomeric SMILES

CCC1=C(N=C(NC1=O)SCC(=O)NCCC2=CC=CC=C2)O

InChI

InChI=1S/C16H19N3O3S/c1-2-12-14(21)18-16(19-15(12)22)23-10-13(20)17-9-8-11-6-4-3-5-7-11/h3-7H,2,8-10H2,1H3,(H,17,20)(H2,18,19,21,22)