N-[4-[2-(4-phenylphthalazin-1-yl)sulfanylethanoyl]phenyl]propanamide

Systemtic Name: N-[4-[2-(4-phenylphthalazin-1-yl)sulfanylethanoyl]phenyl]propanamide Openeye Name: N-[4-[2-(4-phenylphthalazin-1-yl)sulfanylacetyl]phenyl]propanamide CAS Name: N-[4-[1-oxo-2-[(4-phenyl-1-phthalazinyl)thio]ethyl]phenyl]propanamide IUPAC Name: N-[4-[2-(4-phenylphthalazin-1-yl)sulfanylacetyl]phenyl]propanamide Traditional Name: N-[4-[2-[(4-phenylphthalazin-1-yl)thio]acetyl]phenyl]propionamide Formula: C25H21N3O2S MolecularWeight: 427.51814

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Descriptors Computed from Structure

Canonical SMILES:

CCC(=O)NC1=CC=C(C=C1)C(=O)CSC2=NN=C(C3=CC=CC=C32)C4=CC=CC=C4

Isomeric SMILES

CCC(=O)NC1=CC=C(C=C1)C(=O)CSC2=NN=C(C3=CC=CC=C32)C4=CC=CC=C4

InChI

InChI=1S/C25H21N3O2S/c1-2-23(30)26-19-14-12-17(13-15-19)22(29)16-31-25-21-11-7-6-10-20(21)24(27-28-25)18-8-4-3-5-9-18/h3-15H,2,16H2,1H3,(H,26,30)