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

Systemtic Name: 4-(4,6-dimethylpyrimidin-2-yl)sulfanyl-N-phenyl-butanamide Openeye Name: 4-(4,6-dimethylpyrimidin-2-yl)sulfanyl-N-phenyl-butanamide CAS Name: 4-[(4,6-dimethyl-2-pyrimidinyl)thio]-N-phenylbutanamide IUPAC Name: 4-(4,6-dimethylpyrimidin-2-yl)sulfanyl-N-phenylbutanamide Traditional Name: 4-[(4,6-dimethylpyrimidin-2-yl)thio]-N-phenyl-butyramide Formula: C16H19N3OS MolecularWeight: 301.40656

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=NC(=N1)SCCCC(=O)NC2=CC=CC=C2)C

Isomeric SMILES

CC1=CC(=NC(=N1)SCCCC(=O)NC2=CC=CC=C2)C

InChI

InChI=1S/C16H19N3OS/c1-12-11-13(2)18-16(17-12)21-10-6-9-15(20)19-14-7-4-3-5-8-14/h3-5,7-8,11H,6,9-10H2,1-2H3,(H,19,20)