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

Systemtic Name: N,N-diethyl-2-[6-oxidanyl-4-oxidanylidene-5-(phenylmethyl)-1-prop-2-enyl-pyrimidin-2-yl]sulfanyl-ethanamide Openeye Name: 2-(1-allyl-5-benzyl-6-hydroxy-4-oxo-pyrimidin-2-yl)sulfanyl-N,N-diethyl-acetamide CAS Name: N,N-diethyl-2-[[6-hydroxy-4-oxo-5-(phenylmethyl)-1-prop-2-enyl-2-pyrimidinyl]thio]acetamide IUPAC Name: 2-(5-benzyl-6-hydroxy-4-oxo-1-prop-2-enylpyrimidin-2-yl)sulfanyl-N,N-diethylacetamide Traditional Name: 2-[(1-allyl-5-benzyl-6-hydroxy-4-keto-pyrimidin-2-yl)thio]-N,N-diethyl-acetamide Formula: C20H25N3O3S MolecularWeight: 387.4958

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)C(=O)CSC1=NC(=O)C(=C(N1CC=C)O)CC2=CC=CC=C2

Isomeric SMILES

CCN(CC)C(=O)CSC1=NC(=O)C(=C(N1CC=C)O)CC2=CC=CC=C2

InChI

InChI=1S/C20H25N3O3S/c1-4-12-23-19(26)16(13-15-10-8-7-9-11-15)18(25)21-20(23)27-14-17(24)22(5-2)6-3/h4,7-11,26H,1,5-6,12-14H2,2-3H3