N-[2-(3-methylphenoxy)ethyl]-2-(4-phenylphthalazin-1-yl)sulfanyl-ethanamide

Systemtic Name: N-[2-(3-methylphenoxy)ethyl]-2-(4-phenylphthalazin-1-yl)sulfanyl-ethanamide Openeye Name: N-[2-(3-methylphenoxy)ethyl]-2-(4-phenylphthalazin-1-yl)sulfanyl-acetamide CAS Name: N-[2-(3-methylphenoxy)ethyl]-2-[(4-phenyl-1-phthalazinyl)thio]acetamide IUPAC Name: N-[2-(3-methylphenoxy)ethyl]-2-(4-phenylphthalazin-1-yl)sulfanylacetamide Traditional Name: N-[2-(3-methylphenoxy)ethyl]-2-[(4-phenylphthalazin-1-yl)thio]acetamide Formula: C25H23N3O2S MolecularWeight: 429.53402

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC=C1)OCCNC(=O)CSC2=NN=C(C3=CC=CC=C32)C4=CC=CC=C4

Isomeric SMILES

CC1=CC(=CC=C1)OCCNC(=O)CSC2=NN=C(C3=CC=CC=C32)C4=CC=CC=C4

InChI

InChI=1S/C25H23N3O2S/c1-18-8-7-11-20(16-18)30-15-14-26-23(29)17-31-25-22-13-6-5-12-21(22)24(27-28-25)19-9-3-2-4-10-19/h2-13,16H,14-15,17H2,1H3,(H,26,29)