N-(3,5-dimethylphenyl)-2-(2-methylsulfanyl-6-oxidanylidene-4-phenyl-pyrimidin-1-yl)ethanamide

Systemtic Name: N-(3,5-dimethylphenyl)-2-(2-methylsulfanyl-6-oxidanylidene-4-phenyl-pyrimidin-1-yl)ethanamide Openeye Name: N-(3,5-dimethylphenyl)-2-(2-methylsulfanyl-6-oxo-4-phenyl-pyrimidin-1-yl)acetamide CAS Name: N-(3,5-dimethylphenyl)-2-[2-(methylthio)-6-oxo-4-phenyl-1-pyrimidinyl]acetamide IUPAC Name: N-(3,5-dimethylphenyl)-2-(2-methylsulfanyl-6-oxo-4-phenylpyrimidin-1-yl)acetamide Traditional Name: N-(3,5-dimethylphenyl)-2-[6-keto-2-(methylthio)-4-phenyl-pyrimidin-1-yl]acetamide Formula: C21H21N3O2S MolecularWeight: 379.47534

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC(=C1)NC(=O)CN2C(=O)C=C(N=C2SC)C3=CC=CC=C3)C

Isomeric SMILES

CC1=CC(=CC(=C1)NC(=O)CN2C(=O)C=C(N=C2SC)C3=CC=CC=C3)C

InChI

InChI=1S/C21H21N3O2S/c1-14-9-15(2)11-17(10-14)22-19(25)13-24-20(26)12-18(23-21(24)27-3)16-7-5-4-6-8-16/h4-12H,13H2,1-3H3,(H,22,25)