N-(2-chloranyl-4-methyl-phenyl)-2-(4,6-diphenylpyrimidin-2-yl)sulfanyl-ethanamide

Systemtic Name: N-(2-chloranyl-4-methyl-phenyl)-2-(4,6-diphenylpyrimidin-2-yl)sulfanyl-ethanamide Openeye Name: N-(2-chloro-4-methyl-phenyl)-2-(4,6-diphenylpyrimidin-2-yl)sulfanyl-acetamide CAS Name: N-(2-chloro-4-methylphenyl)-2-[(4,6-diphenyl-2-pyrimidinyl)thio]acetamide IUPAC Name: N-(2-chloro-4-methylphenyl)-2-(4,6-diphenylpyrimidin-2-yl)sulfanylacetamide Traditional Name: N-(2-chloro-4-methyl-phenyl)-2-[(4,6-diphenylpyrimidin-2-yl)thio]acetamide Formula: C25H20ClN3OS MolecularWeight: 445.9638

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)NC(=O)CSC2=NC(=CC(=N2)C3=CC=CC=C3)C4=CC=CC=C4)Cl

Isomeric SMILES

CC1=CC(=C(C=C1)NC(=O)CSC2=NC(=CC(=N2)C3=CC=CC=C3)C4=CC=CC=C4)Cl

InChI

InChI=1S/C25H20ClN3OS/c1-17-12-13-21(20(26)14-17)27-24(30)16-31-25-28-22(18-8-4-2-5-9-18)15-23(29-25)19-10-6-3-7-11-19/h2-15H,16H2,1H3,(H,27,30)