(2R)-1-(4-ethylphenyl)-2-(4-phenylphthalazin-1-yl)sulfanyl-propan-1-one

Systemtic Name: (2R)-1-(4-ethylphenyl)-2-(4-phenylphthalazin-1-yl)sulfanyl-propan-1-one Openeye Name: (2R)-1-(4-ethylphenyl)-2-(4-phenylphthalazin-1-yl)sulfanyl-propan-1-one CAS Name: (2R)-1-(4-ethylphenyl)-2-[(4-phenyl-1-phthalazinyl)thio]-1-propanone IUPAC Name: (2R)-1-(4-ethylphenyl)-2-(4-phenylphthalazin-1-yl)sulfanylpropan-1-one Traditional Name: (2R)-1-(4-ethylphenyl)-2-[(4-phenylphthalazin-1-yl)thio]propan-1-one Formula: C25H22N2OS MolecularWeight: 398.51998

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC=C(C=C1)C(=O)C(C)SC2=NN=C(C3=CC=CC=C32)C4=CC=CC=C4

Isomeric SMILES

CCC1=CC=C(C=C1)C(=O)[C@@H](C)SC2=NN=C(C3=CC=CC=C32)C4=CC=CC=C4

InChI

InChI=1S/C25H22N2OS/c1-3-18-13-15-20(16-14-18)24(28)17(2)29-25-22-12-8-7-11-21(22)23(26-27-25)19-9-5-4-6-10-19/h4-17H,3H2,1-2H3/t17-/m1/s1