N-(3-ethanoylphenyl)-2-(2-methyl-4-oxidanylidene-[1]benzothiolo[3,2-d]pyrimidin-3-yl)ethanamide

Systemtic Name: N-(3-ethanoylphenyl)-2-(2-methyl-4-oxidanylidene-[1]benzothiolo[3,2-d]pyrimidin-3-yl)ethanamide Openeye Name: N-(3-acetylphenyl)-2-(2-methyl-4-oxo-benzothiopheno[3,2-d]pyrimidin-3-yl)acetamide CAS Name: N-(3-acetylphenyl)-2-(2-methyl-4-oxo-[1]benzothiolo[3,2-d]pyrimidin-3-yl)acetamide IUPAC Name: N-(3-acetylphenyl)-2-(2-methyl-4-oxo-[1]benzothiolo[3,2-d]pyrimidin-3-yl)acetamide Traditional Name: N-(3-acetylphenyl)-2-(4-keto-2-methyl-benzothiopheno[3,2-d]pyrimidin-3-yl)acetamide Formula: C21H17N3O3S MolecularWeight: 391.44298

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC2=C(C(=O)N1CC(=O)NC3=CC=CC(=C3)C(=O)C)SC4=CC=CC=C42

Isomeric SMILES

CC1=NC2=C(C(=O)N1CC(=O)NC3=CC=CC(=C3)C(=O)C)SC4=CC=CC=C42

InChI

InChI=1S/C21H17N3O3S/c1-12(25)14-6-5-7-15(10-14)23-18(26)11-24-13(2)22-19-16-8-3-4-9-17(16)28-20(19)21(24)27/h3-10H,11H2,1-2H3,(H,23,26)