6-(4-ethoxyphenyl)-3-(4-ethylphenyl)-2,5-bis(sulfanylidene)-4H-[1,3]thiazolo[4,5-d]pyrimidin-7-one

Systemtic Name: 6-(4-ethoxyphenyl)-3-(4-ethylphenyl)-2,5-bis(sulfanylidene)-4H-[1,3]thiazolo[4,5-d]pyrimidin-7-one Openeye Name: 6-(4-ethoxyphenyl)-3-(4-ethylphenyl)-2,5-dithioxo-4H-thiazolo[4,5-d]pyrimidin-7-one CAS Name: 6-(4-ethoxyphenyl)-3-(4-ethylphenyl)-2,5-bis(sulfanylidene)-4H-thiazolo[4,5-d]pyrimidin-7-one IUPAC Name: 6-(4-ethoxyphenyl)-3-(4-ethylphenyl)-2,5-bis(sulfanylidene)-4H-[1,3]thiazolo[4,5-d]pyrimidin-7-one Traditional Name: 3-(4-ethylphenyl)-6-p-phenetyl-2,5-dithioxo-4H-thiazolo[4,5-d]pyrimidin-7-one Formula: C21H19N3O2S3 MolecularWeight: 441.58946

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC=C(C=C1)N2C3=C(C(=O)N(C(=S)N3)C4=CC=C(C=C4)OCC)SC2=S

Isomeric SMILES

CCC1=CC=C(C=C1)N2C3=C(C(=O)N(C(=S)N3)C4=CC=C(C=C4)OCC)SC2=S

InChI

InChI=1S/C21H19N3O2S3/c1-3-13-5-7-14(8-6-13)23-18-17(29-21(23)28)19(25)24(20(27)22-18)15-9-11-16(12-10-15)26-4-2/h5-12H,3-4H2,1-2H3,(H,22,27)