1-[(3-phenyl-[1,2]thiazolo[4,5-d]pyrimidin-7-yl)sulfanyl]propan-2-one

Systemtic Name: 1-[(3-phenyl-[1,2]thiazolo[4,5-d]pyrimidin-7-yl)sulfanyl]propan-2-one Openeye Name: 1-(3-phenylisothiazolo[4,5-d]pyrimidin-7-yl)sulfanylpropan-2-one CAS Name: 1-[(3-phenyl-7-isothiazolo[4,5-d]pyrimidinyl)thio]-2-propanone IUPAC Name: 1-[(3-phenyl-[1,2]thiazolo[4,5-d]pyrimidin-7-yl)sulfanyl]propan-2-one Traditional Name: 1-[(3-phenylisothiazolo[4,5-d]pyrimidin-7-yl)thio]acetone Formula: C14H11N3OS2 MolecularWeight: 301.38664

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)CSC1=NC=NC2=C1SN=C2C3=CC=CC=C3

Isomeric SMILES

CC(=O)CSC1=NC=NC2=C1SN=C2C3=CC=CC=C3

InChI

InChI=1S/C14H11N3OS2/c1-9(18)7-19-14-13-12(15-8-16-14)11(17-20-13)10-5-3-2-4-6-10/h2-6,8H,7H2,1H3