N-(4-ethanoylphenyl)-2-(3-ethyl-7-methyl-4-oxidanylidene-pyrimido[4,5-d]pyrimidin-2-yl)sulfanyl-ethanamide

Systemtic Name: N-(4-ethanoylphenyl)-2-(3-ethyl-7-methyl-4-oxidanylidene-pyrimido[4,5-d]pyrimidin-2-yl)sulfanyl-ethanamide Openeye Name: N-(4-acetylphenyl)-2-(3-ethyl-7-methyl-4-oxo-pyrimido[4,5-d]pyrimidin-2-yl)sulfanyl-acetamide CAS Name: N-(4-acetylphenyl)-2-[(3-ethyl-7-methyl-4-oxo-2-pyrimido[4,5-d]pyrimidinyl)thio]acetamide IUPAC Name: N-(4-acetylphenyl)-2-(3-ethyl-7-methyl-4-oxopyrimido[4,5-d]pyrimidin-2-yl)sulfanylacetamide Traditional Name: N-(4-acetylphenyl)-2-[(3-ethyl-4-keto-7-methyl-pyrimido[4,5-d]pyrimidin-2-yl)thio]acetamide Formula: C19H19N5O3S MolecularWeight: 397.45086

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C(=O)C2=CN=C(N=C2N=C1SCC(=O)NC3=CC=C(C=C3)C(=O)C)C

Isomeric SMILES

CCN1C(=O)C2=CN=C(N=C2N=C1SCC(=O)NC3=CC=C(C=C3)C(=O)C)C

InChI

InChI=1S/C19H19N5O3S/c1-4-24-18(27)15-9-20-12(3)21-17(15)23-19(24)28-10-16(26)22-14-7-5-13(6-8-14)11(2)25/h5-9H,4,10H2,1-3H3,(H,22,26)