2-[[3-(4-ethoxyphenyl)-7-oxidanylidene-6-phenyl-2-sulfanylidene-[1,3]thiazolo[4,5-d]pyrimidin-5-yl]sulfanyl]-N-(5-methyl-1H-pyrazol-3-yl)ethanamide

Systemtic Name: 2-[[3-(4-ethoxyphenyl)-7-oxidanylidene-6-phenyl-2-sulfanylidene-[1,3]thiazolo[4,5-d]pyrimidin-5-yl]sulfanyl]-N-(5-methyl-1H-pyrazol-3-yl)ethanamide Openeye Name: 2-[3-(4-ethoxyphenyl)-7-oxo-6-phenyl-2-thioxo-thiazolo[4,5-d]pyrimidin-5-yl]sulfanyl-N-(5-methyl-1H-pyrazol-3-yl)acetamide CAS Name: 2-[[3-(4-ethoxyphenyl)-7-oxo-6-phenyl-2-sulfanylidene-5-thiazolo[4,5-d]pyrimidinyl]thio]-N-(5-methyl-1H-pyrazol-3-yl)acetamide IUPAC Name: 2-[[3-(4-ethoxyphenyl)-7-oxo-6-phenyl-2-sulfanylidene-[1,3]thiazolo[4,5-d]pyrimidin-5-yl]sulfanyl]-N-(5-methyl-1H-pyrazol-3-yl)acetamide Traditional Name: 2-[(7-keto-6-phenyl-3-p-phenetyl-2-thioxo-thiazolo[4,5-d]pyrimidin-5-yl)thio]-N-(5-methyl-1H-pyrazol-3-yl)acetamide Formula: C25H22N6O3S3 MolecularWeight: 550.67558

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=C(C=C1)N2C3=C(C(=O)N(C(=N3)SCC(=O)NC4=NNC(=C4)C)C5=CC=CC=C5)SC2=S

Isomeric SMILES

CCOC1=CC=C(C=C1)N2C3=C(C(=O)N(C(=N3)SCC(=O)NC4=NNC(=C4)C)C5=CC=CC=C5)SC2=S

InChI

InChI=1S/C25H22N6O3S3/c1-3-34-18-11-9-17(10-12-18)30-22-21(37-25(30)35)23(33)31(16-7-5-4-6-8-16)24(27-22)36-14-20(32)26-19-13-15(2)28-29-19/h4-13H,3,14H2,1-2H3,(H2,26,28,29,32)