N-(4-butylphenyl)-2-(4,6-dimethylpyrimidin-2-yl)sulfanyl-ethanamide

Systemtic Name: N-(4-butylphenyl)-2-(4,6-dimethylpyrimidin-2-yl)sulfanyl-ethanamide Openeye Name: N-(4-butylphenyl)-2-(4,6-dimethylpyrimidin-2-yl)sulfanyl-acetamide CAS Name: N-(4-butylphenyl)-2-[(4,6-dimethyl-2-pyrimidinyl)thio]acetamide IUPAC Name: N-(4-butylphenyl)-2-(4,6-dimethylpyrimidin-2-yl)sulfanylacetamide Traditional Name: N-(4-butylphenyl)-2-[(4,6-dimethylpyrimidin-2-yl)thio]acetamide Formula: C18H23N3OS MolecularWeight: 329.45972

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC1=CC=C(C=C1)NC(=O)CSC2=NC(=CC(=N2)C)C

Isomeric SMILES

CCCCC1=CC=C(C=C1)NC(=O)CSC2=NC(=CC(=N2)C)C

InChI

InChI=1S/C18H23N3OS/c1-4-5-6-15-7-9-16(10-8-15)21-17(22)12-23-18-19-13(2)11-14(3)20-18/h7-11H,4-6,12H2,1-3H3,(H,21,22)