3-(2,5-dimethoxyphenyl)-5-(1,3-dioxolan-2-ylmethylsulfanyl)-6-(2-methylphenyl)-2-sulfanylidene-[1,3]thiazolo[4,5-d]pyrimidin-7-one

Systemtic Name: 3-(2,5-dimethoxyphenyl)-5-(1,3-dioxolan-2-ylmethylsulfanyl)-6-(2-methylphenyl)-2-sulfanylidene-[1,3]thiazolo[4,5-d]pyrimidin-7-one Openeye Name: 3-(2,5-dimethoxyphenyl)-5-(1,3-dioxolan-2-ylmethylsulfanyl)-6-(o-tolyl)-2-thioxo-thiazolo[4,5-d]pyrimidin-7-one CAS Name: 3-(2,5-dimethoxyphenyl)-5-(1,3-dioxolan-2-ylmethylthio)-6-(2-methylphenyl)-2-sulfanylidene-7-thiazolo[4,5-d]pyrimidinone IUPAC Name: 3-(2,5-dimethoxyphenyl)-5-(1,3-dioxolan-2-ylmethylsulfanyl)-6-(2-methylphenyl)-2-sulfanylidene-[1,3]thiazolo[4,5-d]pyrimidin-7-one Traditional Name: 3-(2,5-dimethoxyphenyl)-5-(1,3-dioxolan-2-ylmethylthio)-6-(o-tolyl)-2-thioxo-thiazolo[4,5-d]pyrimidin-7-one Formula: C24H23N3O5S3 MolecularWeight: 529.65152

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1N2C(=O)C3=C(N=C2SCC4OCCO4)N(C(=S)S3)C5=C(C=CC(=C5)OC)OC

Isomeric SMILES

CC1=CC=CC=C1N2C(=O)C3=C(N=C2SCC4OCCO4)N(C(=S)S3)C5=C(C=CC(=C5)OC)OC

InChI

InChI=1S/C24H23N3O5S3/c1-14-6-4-5-7-16(14)27-22(28)20-21(25-23(27)34-13-19-31-10-11-32-19)26(24(33)35-20)17-12-15(29-2)8-9-18(17)30-3/h4-9,12,19H,10-11,13H2,1-3H3