2-[2,6-bis(oxidanylidene)-3-(phenylmethyl)pyrimidin-1-yl]-N-(2-methyl-5-methylsulfonyl-phenyl)ethanamide

Systemtic Name: 2-[2,6-bis(oxidanylidene)-3-(phenylmethyl)pyrimidin-1-yl]-N-(2-methyl-5-methylsulfonyl-phenyl)ethanamide Openeye Name: 2-(3-benzyl-2,6-dioxo-pyrimidin-1-yl)-N-(2-methyl-5-methylsulfonyl-phenyl)acetamide CAS Name: 2-[2,6-dioxo-3-(phenylmethyl)-1-pyrimidinyl]-N-(2-methyl-5-methylsulfonylphenyl)acetamide IUPAC Name: 2-(3-benzyl-2,6-dioxopyrimidin-1-yl)-N-(2-methyl-5-methylsulfonylphenyl)acetamide Traditional Name: 2-(3-benzyl-2,6-diketo-pyrimidin-1-yl)-N-(5-mesyl-2-methyl-phenyl)acetamide Formula: C21H21N3O5S MolecularWeight: 427.47354

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)S(=O)(=O)C)NC(=O)CN2C(=O)C=CN(C2=O)CC3=CC=CC=C3

Isomeric SMILES

CC1=C(C=C(C=C1)S(=O)(=O)C)NC(=O)CN2C(=O)C=CN(C2=O)CC3=CC=CC=C3

InChI

InChI=1S/C21H21N3O5S/c1-15-8-9-17(30(2,28)29)12-18(15)22-19(25)14-24-20(26)10-11-23(21(24)27)13-16-6-4-3-5-7-16/h3-12H,13-14H2,1-2H3,(H,22,25)