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

Systemtic Name: N-(1,3-benzothiazol-2-yl)-2-(4,6-dimethylpyrimidin-2-yl)sulfanyl-butanamide Openeye Name: N-(1,3-benzothiazol-2-yl)-2-(4,6-dimethylpyrimidin-2-yl)sulfanyl-butanamide CAS Name: N-(1,3-benzothiazol-2-yl)-2-[(4,6-dimethyl-2-pyrimidinyl)thio]butanamide IUPAC Name: N-(1,3-benzothiazol-2-yl)-2-(4,6-dimethylpyrimidin-2-yl)sulfanylbutanamide Traditional Name: N-(1,3-benzothiazol-2-yl)-2-[(4,6-dimethylpyrimidin-2-yl)thio]butyramide Formula: C17H18N4OS2 MolecularWeight: 358.48102

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C(=O)NC1=NC2=CC=CC=C2S1)SC3=NC(=CC(=N3)C)C

Isomeric SMILES

CCC(C(=O)NC1=NC2=CC=CC=C2S1)SC3=NC(=CC(=N3)C)C

InChI

InChI=1S/C17H18N4OS2/c1-4-13(23-16-18-10(2)9-11(3)19-16)15(22)21-17-20-12-7-5-6-8-14(12)24-17/h5-9,13H,4H2,1-3H3,(H,20,21,22)