N-(4-bromanyl-2-methyl-phenyl)-2-(4-oxidanylidene-5-phenyl-thieno[2,3-d]pyrimidin-3-yl)ethanamide

Systemtic Name: N-(4-bromanyl-2-methyl-phenyl)-2-(4-oxidanylidene-5-phenyl-thieno[2,3-d]pyrimidin-3-yl)ethanamide Openeye Name: N-(4-bromo-2-methyl-phenyl)-2-(4-oxo-5-phenyl-thieno[2,3-d]pyrimidin-3-yl)acetamide CAS Name: N-(4-bromo-2-methylphenyl)-2-(4-oxo-5-phenyl-3-thieno[2,3-d]pyrimidinyl)acetamide IUPAC Name: N-(4-bromo-2-methylphenyl)-2-(4-oxo-5-phenylthieno[2,3-d]pyrimidin-3-yl)acetamide Traditional Name: N-(4-bromo-2-methyl-phenyl)-2-(4-keto-5-phenyl-thieno[2,3-d]pyrimidin-3-yl)acetamide Formula: C21H16BrN3O2S MolecularWeight: 454.33964

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1)Br)NC(=O)CN2C=NC3=C(C2=O)C(=CS3)C4=CC=CC=C4

Isomeric SMILES

CC1=C(C=CC(=C1)Br)NC(=O)CN2C=NC3=C(C2=O)C(=CS3)C4=CC=CC=C4

InChI

InChI=1S/C21H16BrN3O2S/c1-13-9-15(22)7-8-17(13)24-18(26)10-25-12-23-20-19(21(25)27)16(11-28-20)14-5-3-2-4-6-14/h2-9,11-12H,10H2,1H3,(H,24,26)