N,N-diethyl-2-[[4-oxidanyl-6-oxidanylidene-5-(phenylmethyl)-1H-pyrimidin-2-yl]sulfanyl]ethanamide

Systemtic Name: N,N-diethyl-2-[[4-oxidanyl-6-oxidanylidene-5-(phenylmethyl)-1H-pyrimidin-2-yl]sulfanyl]ethanamide Openeye Name: 2-[(5-benzyl-4-hydroxy-6-oxo-1H-pyrimidin-2-yl)sulfanyl]-N,N-diethyl-acetamide CAS Name: N,N-diethyl-2-[[4-hydroxy-6-oxo-5-(phenylmethyl)-1H-pyrimidin-2-yl]thio]acetamide IUPAC Name: 2-[(5-benzyl-4-hydroxy-6-oxo-1H-pyrimidin-2-yl)sulfanyl]-N,N-diethylacetamide Traditional Name: 2-[(5-benzyl-4-hydroxy-6-keto-1H-pyrimidin-2-yl)thio]-N,N-diethyl-acetamide Formula: C17H21N3O3S MolecularWeight: 347.43194

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)C(=O)CSC1=NC(=C(C(=O)N1)CC2=CC=CC=C2)O

Isomeric SMILES

CCN(CC)C(=O)CSC1=NC(=C(C(=O)N1)CC2=CC=CC=C2)O

InChI

InChI=1S/C17H21N3O3S/c1-3-20(4-2)14(21)11-24-17-18-15(22)13(16(23)19-17)10-12-8-6-5-7-9-12/h5-9H,3-4,10-11H2,1-2H3,(H2,18,19,22,23)