N-(2,3-dihydro-1H-inden-5-yl)-2-(4-phenylphthalazin-1-yl)sulfanyl-ethanamide

Systemtic Name: N-(2,3-dihydro-1H-inden-5-yl)-2-(4-phenylphthalazin-1-yl)sulfanyl-ethanamide Openeye Name: N-indan-5-yl-2-(4-phenylphthalazin-1-yl)sulfanyl-acetamide CAS Name: N-(2,3-dihydro-1H-inden-5-yl)-2-[(4-phenyl-1-phthalazinyl)thio]acetamide IUPAC Name: N-(2,3-dihydro-1H-inden-5-yl)-2-(4-phenylphthalazin-1-yl)sulfanylacetamide Traditional Name: N-indan-5-yl-2-[(4-phenylphthalazin-1-yl)thio]acetamide Formula: C25H21N3OS MolecularWeight: 411.51874

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Descriptors Computed from Structure

Canonical SMILES:

C1CC2=C(C1)C=C(C=C2)NC(=O)CSC3=NN=C(C4=CC=CC=C43)C5=CC=CC=C5

Isomeric SMILES

C1CC2=C(C1)C=C(C=C2)NC(=O)CSC3=NN=C(C4=CC=CC=C43)C5=CC=CC=C5

InChI

InChI=1S/C25H21N3OS/c29-23(26-20-14-13-17-9-6-10-19(17)15-20)16-30-25-22-12-5-4-11-21(22)24(27-28-25)18-7-2-1-3-8-18/h1-5,7-8,11-15H,6,9-10,16H2,(H,26,29)