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

Systemtic Name: 3-(phenylmethyl)-2-sulfanylidene-4H-[1,3]thiazolo[4,5-d]pyrimidin-7-one Openeye Name: 3-benzyl-2-thioxo-4H-thiazolo[4,5-d]pyrimidin-7-one CAS Name: 3-(phenylmethyl)-2-sulfanylidene-4H-thiazolo[4,5-d]pyrimidin-7-one IUPAC Name: 3-benzyl-2-sulfanylidene-4H-[1,3]thiazolo[4,5-d]pyrimidin-7-one Traditional Name: 3-benzyl-2-thioxo-4H-thiazolo[4,5-d]pyrimidin-7-one Formula: C12H9N3OS2 MolecularWeight: 275.34936

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CN2C3=C(C(=O)N=CN3)SC2=S

Isomeric SMILES

C1=CC=C(C=C1)CN2C3=C(C(=O)N=CN3)SC2=S

InChI

InChI=1S/C12H9N3OS2/c16-11-9-10(13-7-14-11)15(12(17)18-9)6-8-4-2-1-3-5-8/h1-5,7H,6H2,(H,13,14,16)