1-(1,3-benzodioxol-5-yl)-2-(4-phenylphthalazin-1-yl)sulfanyl-ethanone

Systemtic Name: 1-(1,3-benzodioxol-5-yl)-2-(4-phenylphthalazin-1-yl)sulfanyl-ethanone Openeye Name: 1-(1,3-benzodioxol-5-yl)-2-(4-phenylphthalazin-1-yl)sulfanyl-ethanone CAS Name: 1-(1,3-benzodioxol-5-yl)-2-[(4-phenyl-1-phthalazinyl)thio]ethanone IUPAC Name: 1-(1,3-benzodioxol-5-yl)-2-(4-phenylphthalazin-1-yl)sulfanylethanone Traditional Name: 1-(1,3-benzodioxol-5-yl)-2-[(4-phenylphthalazin-1-yl)thio]ethanone Formula: C23H16N2O3S MolecularWeight: 400.44974

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Descriptors Computed from Structure

Canonical SMILES:

C1OC2=C(O1)C=C(C=C2)C(=O)CSC3=NN=C(C4=CC=CC=C43)C5=CC=CC=C5

Isomeric SMILES

C1OC2=C(O1)C=C(C=C2)C(=O)CSC3=NN=C(C4=CC=CC=C43)C5=CC=CC=C5

InChI

InChI=1S/C23H16N2O3S/c26-19(16-10-11-20-21(12-16)28-14-27-20)13-29-23-18-9-5-4-8-17(18)22(24-25-23)15-6-2-1-3-7-15/h1-12H,13-14H2