3-(4-ethoxyphenyl)-5-[(4-methylphenyl)methylsulfanyl]-2-sulfanylidene-4H-[1,3]thiazolo[4,5-d]pyrimidin-7-one

Systemtic Name: 3-(4-ethoxyphenyl)-5-[(4-methylphenyl)methylsulfanyl]-2-sulfanylidene-4H-[1,3]thiazolo[4,5-d]pyrimidin-7-one Openeye Name: 3-(4-ethoxyphenyl)-5-(p-tolylmethylsulfanyl)-2-thioxo-4H-thiazolo[4,5-d]pyrimidin-7-one CAS Name: 3-(4-ethoxyphenyl)-5-[(4-methylphenyl)methylthio]-2-sulfanylidene-4H-thiazolo[4,5-d]pyrimidin-7-one IUPAC Name: 3-(4-ethoxyphenyl)-5-[(4-methylphenyl)methylsulfanyl]-2-sulfanylidene-4H-[1,3]thiazolo[4,5-d]pyrimidin-7-one Traditional Name: 5-[(4-methylbenzyl)thio]-3-p-phenetyl-2-thioxo-4H-thiazolo[4,5-d]pyrimidin-7-one Formula: C21H19N3O2S3 MolecularWeight: 441.58946

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=C(C=C1)N2C3=C(C(=O)N=C(N3)SCC4=CC=C(C=C4)C)SC2=S

Isomeric SMILES

CCOC1=CC=C(C=C1)N2C3=C(C(=O)N=C(N3)SCC4=CC=C(C=C4)C)SC2=S

InChI

InChI=1S/C21H19N3O2S3/c1-3-26-16-10-8-15(9-11-16)24-18-17(29-21(24)27)19(25)23-20(22-18)28-12-14-6-4-13(2)5-7-14/h4-11H,3,12H2,1-2H3,(H,22,23,25)