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

Systemtic Name: 5-methyl-3-(phenylmethyl)-2-sulfanylidene-4H-[1,3]thiazolo[4,5-d]pyrimidin-7-one Openeye Name: 3-benzyl-5-methyl-2-thioxo-4H-thiazolo[4,5-d]pyrimidin-7-one CAS Name: 5-methyl-3-(phenylmethyl)-2-sulfanylidene-4H-thiazolo[4,5-d]pyrimidin-7-one IUPAC Name: 3-benzyl-5-methyl-2-sulfanylidene-4H-[1,3]thiazolo[4,5-d]pyrimidin-7-one Traditional Name: 3-benzyl-5-methyl-2-thioxo-4H-thiazolo[4,5-d]pyrimidin-7-one Formula: C13H11N3OS2 MolecularWeight: 289.37594

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC(=O)C2=C(N1)N(C(=S)S2)CC3=CC=CC=C3

Isomeric SMILES

CC1=NC(=O)C2=C(N1)N(C(=S)S2)CC3=CC=CC=C3

InChI

InChI=1S/C13H11N3OS2/c1-8-14-11-10(12(17)15-8)19-13(18)16(11)7-9-5-3-2-4-6-9/h2-6H,7H2,1H3,(H,14,15,17)