2-[(4-methylpyrimidin-2-yl)sulfanylmethyl]-1,3-benzothiazole

Systemtic Name: 2-[(4-methylpyrimidin-2-yl)sulfanylmethyl]-1,3-benzothiazole Openeye Name: 2-[(4-methylpyrimidin-2-yl)sulfanylmethyl]-1,3-benzothiazole CAS Name: 2-[[(4-methyl-2-pyrimidinyl)thio]methyl]-1,3-benzothiazole IUPAC Name: 2-[(4-methylpyrimidin-2-yl)sulfanylmethyl]-1,3-benzothiazole Traditional Name: 2-[[(4-methylpyrimidin-2-yl)thio]methyl]-1,3-benzothiazole Formula: C13H11N3S2 MolecularWeight: 273.37654

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC(=NC=C1)SCC2=NC3=CC=CC=C3S2

Isomeric SMILES

CC1=NC(=NC=C1)SCC2=NC3=CC=CC=C3S2

InChI

InChI=1S/C13H11N3S2/c1-9-6-7-14-13(15-9)17-8-12-16-10-4-2-3-5-11(10)18-12/h2-7H,8H2,1H3