2-(4-bromanyl-2,5-dimethyl-phenyl)sulfanyl-N-(5,6-dimethyl-4-oxidanylidene-thieno[2,3-d]pyrimidin-3-yl)ethanamide

Systemtic Name: 2-(4-bromanyl-2,5-dimethyl-phenyl)sulfanyl-N-(5,6-dimethyl-4-oxidanylidene-thieno[2,3-d]pyrimidin-3-yl)ethanamide Openeye Name: 2-(4-bromo-2,5-dimethyl-phenyl)sulfanyl-N-(5,6-dimethyl-4-oxo-thieno[2,3-d]pyrimidin-3-yl)acetamide CAS Name: 2-[(4-bromo-2,5-dimethylphenyl)thio]-N-(5,6-dimethyl-4-oxo-3-thieno[2,3-d]pyrimidinyl)acetamide IUPAC Name: 2-(4-bromo-2,5-dimethylphenyl)sulfanyl-N-(5,6-dimethyl-4-oxothieno[2,3-d]pyrimidin-3-yl)acetamide Traditional Name: 2-[(4-bromo-2,5-dimethyl-phenyl)thio]-N-(4-keto-5,6-dimethyl-thieno[2,3-d]pyrimidin-3-yl)acetamide Formula: C18H18BrN3O2S2 MolecularWeight: 452.38842

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1Br)C)SCC(=O)NN2C=NC3=C(C2=O)C(=C(S3)C)C

Isomeric SMILES

CC1=CC(=C(C=C1Br)C)SCC(=O)NN2C=NC3=C(C2=O)C(=C(S3)C)C

InChI

InChI=1S/C18H18BrN3O2S2/c1-9-6-14(10(2)5-13(9)19)25-7-15(23)21-22-8-20-17-16(18(22)24)11(3)12(4)26-17/h5-6,8H,7H2,1-4H3,(H,21,23)