N-(1,3-benzothiazol-2-yl)-2-(6-methylpyrimidin-4-yl)sulfanyl-ethanamide

Systemtic Name: N-(1,3-benzothiazol-2-yl)-2-(6-methylpyrimidin-4-yl)sulfanyl-ethanamide Openeye Name: N-(1,3-benzothiazol-2-yl)-2-(6-methylpyrimidin-4-yl)sulfanyl-acetamide CAS Name: N-(1,3-benzothiazol-2-yl)-2-[(6-methyl-4-pyrimidinyl)thio]acetamide IUPAC Name: N-(1,3-benzothiazol-2-yl)-2-(6-methylpyrimidin-4-yl)sulfanylacetamide Traditional Name: N-(1,3-benzothiazol-2-yl)-2-[(6-methylpyrimidin-4-yl)thio]acetamide Formula: C14H12N4OS2 MolecularWeight: 316.40128

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=NC=N1)SCC(=O)NC2=NC3=CC=CC=C3S2

Isomeric SMILES

CC1=CC(=NC=N1)SCC(=O)NC2=NC3=CC=CC=C3S2

InChI

InChI=1S/C14H12N4OS2/c1-9-6-13(16-8-15-9)20-7-12(19)18-14-17-10-4-2-3-5-11(10)21-14/h2-6,8H,7H2,1H3,(H,17,18,19)