2-(4,6-dimethylpyrimidin-2-yl)sulfanyl-1,3-benzothiazole

Systemtic Name: 2-(4,6-dimethylpyrimidin-2-yl)sulfanyl-1,3-benzothiazole Openeye Name: 2-(4,6-dimethylpyrimidin-2-yl)sulfanyl-1,3-benzothiazole CAS Name: 2-[(4,6-dimethyl-2-pyrimidinyl)thio]-1,3-benzothiazole IUPAC Name: 2-(4,6-dimethylpyrimidin-2-yl)sulfanyl-1,3-benzothiazole Traditional Name: 2-[(4,6-dimethylpyrimidin-2-yl)thio]-1,3-benzothiazole Formula: C13H11N3S2 MolecularWeight: 273.37654

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=NC(=N1)SC2=NC3=CC=CC=C3S2)C

Isomeric SMILES

CC1=CC(=NC(=N1)SC2=NC3=CC=CC=C3S2)C

InChI

InChI=1S/C13H11N3S2/c1-8-7-9(2)15-12(14-8)18-13-16-10-5-3-4-6-11(10)17-13/h3-7H,1-2H3