N-(2-ethyl-6-methyl-phenyl)-2-(4-phenylphthalazin-1-yl)sulfanyl-ethanamide

Systemtic Name: N-(2-ethyl-6-methyl-phenyl)-2-(4-phenylphthalazin-1-yl)sulfanyl-ethanamide Openeye Name: N-(2-ethyl-6-methyl-phenyl)-2-(4-phenylphthalazin-1-yl)sulfanyl-acetamide CAS Name: N-(2-ethyl-6-methylphenyl)-2-[(4-phenyl-1-phthalazinyl)thio]acetamide IUPAC Name: N-(2-ethyl-6-methylphenyl)-2-(4-phenylphthalazin-1-yl)sulfanylacetamide Traditional Name: N-(2-ethyl-6-methyl-phenyl)-2-[(4-phenylphthalazin-1-yl)thio]acetamide Formula: C25H23N3OS MolecularWeight: 413.53462

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC=CC(=C1NC(=O)CSC2=NN=C(C3=CC=CC=C32)C4=CC=CC=C4)C

Isomeric SMILES

CCC1=CC=CC(=C1NC(=O)CSC2=NN=C(C3=CC=CC=C32)C4=CC=CC=C4)C

InChI

InChI=1S/C25H23N3OS/c1-3-18-13-9-10-17(2)23(18)26-22(29)16-30-25-21-15-8-7-14-20(21)24(27-28-25)19-11-5-4-6-12-19/h4-15H,3,16H2,1-2H3,(H,26,29)