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

Systemtic Name: N-(2-bromanyl-4-methyl-phenyl)-2-[3-(4-ethoxyphenyl)-5,6-dimethyl-4-oxidanylidene-thieno[2,3-d]pyrimidin-2-yl]sulfanyl-ethanamide Openeye Name: N-(2-bromo-4-methyl-phenyl)-2-[3-(4-ethoxyphenyl)-5,6-dimethyl-4-oxo-thieno[2,3-d]pyrimidin-2-yl]sulfanyl-acetamide CAS Name: N-(2-bromo-4-methylphenyl)-2-[[3-(4-ethoxyphenyl)-5,6-dimethyl-4-oxo-2-thieno[2,3-d]pyrimidinyl]thio]acetamide IUPAC Name: N-(2-bromo-4-methylphenyl)-2-[3-(4-ethoxyphenyl)-5,6-dimethyl-4-oxothieno[2,3-d]pyrimidin-2-yl]sulfanylacetamide Traditional Name: N-(2-bromo-4-methyl-phenyl)-2-[(4-keto-5,6-dimethyl-3-p-phenetyl-thieno[2,3-d]pyrimidin-2-yl)thio]acetamide Formula: C25H24BrN3O3S2 MolecularWeight: 558.51036

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=C(C=C1)N2C(=O)C3=C(N=C2SCC(=O)NC4=C(C=C(C=C4)C)Br)SC(=C3C)C

Isomeric SMILES

CCOC1=CC=C(C=C1)N2C(=O)C3=C(N=C2SCC(=O)NC4=C(C=C(C=C4)C)Br)SC(=C3C)C

InChI

InChI=1S/C25H24BrN3O3S2/c1-5-32-18-9-7-17(8-10-18)29-24(31)22-15(3)16(4)34-23(22)28-25(29)33-13-21(30)27-20-11-6-14(2)12-19(20)26/h6-12H,5,13H2,1-4H3,(H,27,30)