N-(1,3-benzothiazol-2-yl)-2-(2,6-dimethylpyrimidin-4-yl)sulfanyl-propanamide

Systemtic Name: N-(1,3-benzothiazol-2-yl)-2-(2,6-dimethylpyrimidin-4-yl)sulfanyl-propanamide Openeye Name: N-(1,3-benzothiazol-2-yl)-2-(2,6-dimethylpyrimidin-4-yl)sulfanyl-propanamide CAS Name: N-(1,3-benzothiazol-2-yl)-2-[(2,6-dimethyl-4-pyrimidinyl)thio]propanamide IUPAC Name: N-(1,3-benzothiazol-2-yl)-2-(2,6-dimethylpyrimidin-4-yl)sulfanylpropanamide Traditional Name: N-(1,3-benzothiazol-2-yl)-2-[(2,6-dimethylpyrimidin-4-yl)thio]propionamide Formula: C16H16N4OS2 MolecularWeight: 344.45444

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=NC(=N1)C)SC(C)C(=O)NC2=NC3=CC=CC=C3S2

Isomeric SMILES

CC1=CC(=NC(=N1)C)SC(C)C(=O)NC2=NC3=CC=CC=C3S2

InChI

InChI=1S/C16H16N4OS2/c1-9-8-14(18-11(3)17-9)22-10(2)15(21)20-16-19-12-6-4-5-7-13(12)23-16/h4-8,10H,1-3H3,(H,19,20,21)