N-(4-acetamidophenyl)-2-[6-methyl-4-oxidanylidene-2-(phenylmethylsulfanyl)-1H-pyrimidin-5-yl]ethanamide

Systemtic Name: N-(4-acetamidophenyl)-2-[6-methyl-4-oxidanylidene-2-(phenylmethylsulfanyl)-1H-pyrimidin-5-yl]ethanamide Openeye Name: N-(4-acetamidophenyl)-2-(2-benzylsulfanyl-6-methyl-4-oxo-1H-pyrimidin-5-yl)acetamide CAS Name: N-(4-acetamidophenyl)-2-[6-methyl-4-oxo-2-(phenylmethylthio)-1H-pyrimidin-5-yl]acetamide IUPAC Name: N-(4-acetamidophenyl)-2-(2-benzylsulfanyl-6-methyl-4-oxo-1H-pyrimidin-5-yl)acetamide Traditional Name: N-(4-acetamidophenyl)-2-[2-(benzylthio)-4-keto-6-methyl-1H-pyrimidin-5-yl]acetamide Formula: C22H22N4O3S MolecularWeight: 422.50008

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=O)N=C(N1)SCC2=CC=CC=C2)CC(=O)NC3=CC=C(C=C3)NC(=O)C

Isomeric SMILES

CC1=C(C(=O)N=C(N1)SCC2=CC=CC=C2)CC(=O)NC3=CC=C(C=C3)NC(=O)C

InChI

InChI=1S/C22H22N4O3S/c1-14-19(12-20(28)25-18-10-8-17(9-11-18)24-15(2)27)21(29)26-22(23-14)30-13-16-6-4-3-5-7-16/h3-11H,12-13H2,1-2H3,(H,24,27)(H,25,28)(H,23,26,29)