N-(2-cyanophenyl)-2-(4,6-dimethylpyrimidin-2-yl)sulfanyl-butanamide

Systemtic Name: N-(2-cyanophenyl)-2-(4,6-dimethylpyrimidin-2-yl)sulfanyl-butanamide Openeye Name: N-(2-cyanophenyl)-2-(4,6-dimethylpyrimidin-2-yl)sulfanyl-butanamide CAS Name: N-(2-cyanophenyl)-2-[(4,6-dimethyl-2-pyrimidinyl)thio]butanamide IUPAC Name: N-(2-cyanophenyl)-2-(4,6-dimethylpyrimidin-2-yl)sulfanylbutanamide Traditional Name: N-(2-cyanophenyl)-2-[(4,6-dimethylpyrimidin-2-yl)thio]butyramide Formula: C17H18N4OS MolecularWeight: 326.41602

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C(=O)NC1=CC=CC=C1C#N)SC2=NC(=CC(=N2)C)C

Isomeric SMILES

CCC(C(=O)NC1=CC=CC=C1C#N)SC2=NC(=CC(=N2)C)C

InChI

InChI=1S/C17H18N4OS/c1-4-15(23-17-19-11(2)9-12(3)20-17)16(22)21-14-8-6-5-7-13(14)10-18/h5-9,15H,4H2,1-3H3,(H,21,22)