N-butyl-2-[4-chloranyl-6-[(2,3-dimethylphenyl)amino]pyrimidin-2-yl]sulfanyl-ethanamide

Systemtic Name: N-butyl-2-[4-chloranyl-6-[(2,3-dimethylphenyl)amino]pyrimidin-2-yl]sulfanyl-ethanamide Openeye Name: N-butyl-2-[4-chloro-6-(2,3-dimethylanilino)pyrimidin-2-yl]sulfanyl-acetamide CAS Name: N-butyl-2-[[4-chloro-6-(2,3-dimethylanilino)-2-pyrimidinyl]thio]acetamide IUPAC Name: N-butyl-2-[4-chloro-6-(2,3-dimethylanilino)pyrimidin-2-yl]sulfanylacetamide Traditional Name: N-butyl-2-[[4-chloro-6-(2,3-dimethylanilino)pyrimidin-2-yl]thio]acetamide Formula: C18H23ClN4OS MolecularWeight: 378.91942

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Descriptors Computed from Structure

Canonical SMILES:

CCCCNC(=O)CSC1=NC(=CC(=N1)Cl)NC2=CC=CC(=C2C)C

Isomeric SMILES

CCCCNC(=O)CSC1=NC(=CC(=N1)Cl)NC2=CC=CC(=C2C)C

InChI

InChI=1S/C18H23ClN4OS/c1-4-5-9-20-17(24)11-25-18-22-15(19)10-16(23-18)21-14-8-6-7-12(2)13(14)3/h6-8,10H,4-5,9,11H2,1-3H3,(H,20,24)(H,21,22,23)