2-[[6-(4-fluorophenyl)-3-(furan-2-ylmethyl)-7-oxidanylidene-2-sulfanylidene-[1,3]thiazolo[4,5-d]pyrimidin-5-yl]sulfanyl]-N-[(4-methylphenyl)methyl]ethanamide

Systemtic Name: 2-[[6-(4-fluorophenyl)-3-(furan-2-ylmethyl)-7-oxidanylidene-2-sulfanylidene-[1,3]thiazolo[4,5-d]pyrimidin-5-yl]sulfanyl]-N-[(4-methylphenyl)methyl]ethanamide Openeye Name: 2-[6-(4-fluorophenyl)-3-(2-furylmethyl)-7-oxo-2-thioxo-thiazolo[4,5-d]pyrimidin-5-yl]sulfanyl-N-(p-tolylmethyl)acetamide CAS Name: 2-[[6-(4-fluorophenyl)-3-(2-furanylmethyl)-7-oxo-2-sulfanylidene-5-thiazolo[4,5-d]pyrimidinyl]thio]-N-[(4-methylphenyl)methyl]acetamide IUPAC Name: 2-[[6-(4-fluorophenyl)-3-(furan-2-ylmethyl)-7-oxo-2-sulfanylidene-[1,3]thiazolo[4,5-d]pyrimidin-5-yl]sulfanyl]-N-[(4-methylphenyl)methyl]acetamide Traditional Name: 2-[[6-(4-fluorophenyl)-3-(2-furfuryl)-7-keto-2-thioxo-thiazolo[4,5-d]pyrimidin-5-yl]thio]-N-(4-methylbenzyl)acetamide Formula: C26H21FN4O3S3 MolecularWeight: 552.663343

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)CNC(=O)CSC2=NC3=C(C(=O)N2C4=CC=C(C=C4)F)SC(=S)N3CC5=CC=CO5

Isomeric SMILES

CC1=CC=C(C=C1)CNC(=O)CSC2=NC3=C(C(=O)N2C4=CC=C(C=C4)F)SC(=S)N3CC5=CC=CO5

InChI

InChI=1S/C26H21FN4O3S3/c1-16-4-6-17(7-5-16)13-28-21(32)15-36-25-29-23-22(24(33)31(25)19-10-8-18(27)9-11-19)37-26(35)30(23)14-20-3-2-12-34-20/h2-12H,13-15H2,1H3,(H,28,32)