1-[4-methoxy-3-[(4-phenylphthalazin-1-yl)sulfanylmethyl]phenyl]ethanone

Systemtic Name: 1-[4-methoxy-3-[(4-phenylphthalazin-1-yl)sulfanylmethyl]phenyl]ethanone Openeye Name: 1-[4-methoxy-3-[(4-phenylphthalazin-1-yl)sulfanylmethyl]phenyl]ethanone CAS Name: 1-[4-methoxy-3-[[(4-phenyl-1-phthalazinyl)thio]methyl]phenyl]ethanone IUPAC Name: 1-[4-methoxy-3-[(4-phenylphthalazin-1-yl)sulfanylmethyl]phenyl]ethanone Traditional Name: 1-[4-methoxy-3-[[(4-phenylphthalazin-1-yl)thio]methyl]phenyl]ethanone Formula: C24H20N2O2S MolecularWeight: 400.4928

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C24H20N2O2S/c1-16(27)18-12-13-22(28-2)19(14-18)15-29-24-21-11-7-6-10-20(21)23(25-26-24)17-8-4-3-5-9-17/h3-14H,15H2,1-2H3