2-[[6-[(4-methylpyrimidin-2-yl)sulfanylmethyl]pyridin-2-yl]methylsulfanyl]-1,3-benzothiazole

Systemtic Name: 2-[[6-[(4-methylpyrimidin-2-yl)sulfanylmethyl]pyridin-2-yl]methylsulfanyl]-1,3-benzothiazole Openeye Name: 2-[[6-[(4-methylpyrimidin-2-yl)sulfanylmethyl]-2-pyridyl]methylsulfanyl]-1,3-benzothiazole CAS Name: 2-[[6-[[(4-methyl-2-pyrimidinyl)thio]methyl]-2-pyridinyl]methylthio]-1,3-benzothiazole IUPAC Name: 2-[[6-[(4-methylpyrimidin-2-yl)sulfanylmethyl]pyridin-2-yl]methylsulfanyl]-1,3-benzothiazole Traditional Name: 2-[[6-[[(4-methylpyrimidin-2-yl)thio]methyl]-2-pyridyl]methylthio]-1,3-benzothiazole Formula: C19H16N4S3 MolecularWeight: 396.55214

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC(=NC=C1)SCC2=NC(=CC=C2)CSC3=NC4=CC=CC=C4S3

Isomeric SMILES

CC1=NC(=NC=C1)SCC2=NC(=CC=C2)CSC3=NC4=CC=CC=C4S3

InChI

InChI=1S/C19H16N4S3/c1-13-9-10-20-18(21-13)24-11-14-5-4-6-15(22-14)12-25-19-23-16-7-2-3-8-17(16)26-19/h2-10H,11-12H2,1H3