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

Systemtic Name: N-[2,6-bis(oxidanylidene)-3-phenethyl-pyrimidin-4-yl]-2-(4,6-dimethylpyrimidin-2-yl)sulfanyl-ethanamide Openeye Name: 2-(4,6-dimethylpyrimidin-2-yl)sulfanyl-N-(2,6-dioxo-3-phenethyl-pyrimidin-4-yl)acetamide CAS Name: 2-[(4,6-dimethyl-2-pyrimidinyl)thio]-N-(2,6-dioxo-3-phenethyl-4-pyrimidinyl)acetamide IUPAC Name: 2-(4,6-dimethylpyrimidin-2-yl)sulfanyl-N-(2,6-dioxo-3-phenethylpyrimidin-4-yl)acetamide Traditional Name: N-(2,6-diketo-3-phenethyl-pyrimidin-4-yl)-2-[(4,6-dimethylpyrimidin-2-yl)thio]acetamide Formula: C20H21N5O3S MolecularWeight: 411.47744

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=NC(=N1)SCC(=O)NC2=CC(=O)NC(=O)N2CCC3=CC=CC=C3)C

Isomeric SMILES

CC1=CC(=NC(=N1)SCC(=O)NC2=CC(=O)NC(=O)N2CCC3=CC=CC=C3)C

InChI

InChI=1S/C20H21N5O3S/c1-13-10-14(2)22-19(21-13)29-12-18(27)23-16-11-17(26)24-20(28)25(16)9-8-15-6-4-3-5-7-15/h3-7,10-11H,8-9,12H2,1-2H3,(H,23,27)(H,24,26,28)