(2R)-1-(2,3-dihydro-1H-inden-5-yl)-2-(4-phenylphthalazin-1-yl)sulfanyl-propan-1-one

Systemtic Name: (2R)-1-(2,3-dihydro-1H-inden-5-yl)-2-(4-phenylphthalazin-1-yl)sulfanyl-propan-1-one Openeye Name: (2R)-1-indan-5-yl-2-(4-phenylphthalazin-1-yl)sulfanyl-propan-1-one CAS Name: (2R)-1-(2,3-dihydro-1H-inden-5-yl)-2-[(4-phenyl-1-phthalazinyl)thio]-1-propanone IUPAC Name: (2R)-1-(2,3-dihydro-1H-inden-5-yl)-2-(4-phenylphthalazin-1-yl)sulfanylpropan-1-one Traditional Name: (2R)-1-indan-5-yl-2-[(4-phenylphthalazin-1-yl)thio]propan-1-one Formula: C26H22N2OS MolecularWeight: 410.53068

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)C1=CC2=C(CCC2)C=C1)SC3=NN=C(C4=CC=CC=C43)C5=CC=CC=C5

Isomeric SMILES

C[C@H](C(=O)C1=CC2=C(CCC2)C=C1)SC3=NN=C(C4=CC=CC=C43)C5=CC=CC=C5

InChI

InChI=1S/C26H22N2OS/c1-17(25(29)21-15-14-18-10-7-11-20(18)16-21)30-26-23-13-6-5-12-22(23)24(27-28-26)19-8-3-2-4-9-19/h2-6,8-9,12-17H,7,10-11H2,1H3/t17-/m1/s1