N-[2,6-bis(oxidanylidene)-3-phenethyl-pyrimidin-4-yl]-2-[(4-oxidanylidene-1H-quinazolin-2-yl)sulfanyl]ethanamide

Systemtic Name: N-[2,6-bis(oxidanylidene)-3-phenethyl-pyrimidin-4-yl]-2-[(4-oxidanylidene-1H-quinazolin-2-yl)sulfanyl]ethanamide Openeye Name: N-(2,6-dioxo-3-phenethyl-pyrimidin-4-yl)-2-[(4-oxo-1H-quinazolin-2-yl)sulfanyl]acetamide CAS Name: N-(2,6-dioxo-3-phenethyl-4-pyrimidinyl)-2-[(4-oxo-1H-quinazolin-2-yl)thio]acetamide IUPAC Name: N-(2,6-dioxo-3-phenethylpyrimidin-4-yl)-2-[(4-oxo-1H-quinazolin-2-yl)sulfanyl]acetamide Traditional Name: N-(2,6-diketo-3-phenethyl-pyrimidin-4-yl)-2-[(4-keto-1H-quinazolin-2-yl)thio]acetamide Formula: C22H19N5O4S MolecularWeight: 449.48236

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CCN2C(=CC(=O)NC2=O)NC(=O)CSC3=NC(=O)C4=CC=CC=C4N3

Isomeric SMILES

C1=CC=C(C=C1)CCN2C(=CC(=O)NC2=O)NC(=O)CSC3=NC(=O)C4=CC=CC=C4N3

InChI

InChI=1S/C22H19N5O4S/c28-18-12-17(27(22(31)25-18)11-10-14-6-2-1-3-7-14)24-19(29)13-32-21-23-16-9-5-4-8-15(16)20(30)26-21/h1-9,12H,10-11,13H2,(H,24,29)(H,23,26,30)(H,25,28,31)