N-(2,4-dimethoxyphenyl)-2-(2-methylsulfanyl-6-oxidanylidene-4-phenyl-pyrimidin-1-yl)ethanamide

Systemtic Name: N-(2,4-dimethoxyphenyl)-2-(2-methylsulfanyl-6-oxidanylidene-4-phenyl-pyrimidin-1-yl)ethanamide Openeye Name: N-(2,4-dimethoxyphenyl)-2-(2-methylsulfanyl-6-oxo-4-phenyl-pyrimidin-1-yl)acetamide CAS Name: N-(2,4-dimethoxyphenyl)-2-[2-(methylthio)-6-oxo-4-phenyl-1-pyrimidinyl]acetamide IUPAC Name: N-(2,4-dimethoxyphenyl)-2-(2-methylsulfanyl-6-oxo-4-phenylpyrimidin-1-yl)acetamide Traditional Name: N-(2,4-dimethoxyphenyl)-2-[6-keto-2-(methylthio)-4-phenyl-pyrimidin-1-yl]acetamide Formula: C21H21N3O4S MolecularWeight: 411.47414

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=C(C=C1)NC(=O)CN2C(=O)C=C(N=C2SC)C3=CC=CC=C3)OC

Isomeric SMILES

COC1=CC(=C(C=C1)NC(=O)CN2C(=O)C=C(N=C2SC)C3=CC=CC=C3)OC

InChI

InChI=1S/C21H21N3O4S/c1-27-15-9-10-16(18(11-15)28-2)22-19(25)13-24-20(26)12-17(23-21(24)29-3)14-7-5-4-6-8-14/h4-12H,13H2,1-3H3,(H,22,25)