1-[4-methoxy-3-[(4-pyrazol-1-ylphenyl)methylsulfanylmethyl]phenyl]ethanone

Systemtic Name: 1-[4-methoxy-3-[(4-pyrazol-1-ylphenyl)methylsulfanylmethyl]phenyl]ethanone Openeye Name: 1-[4-methoxy-3-[(4-pyrazol-1-ylphenyl)methylsulfanylmethyl]phenyl]ethanone CAS Name: 1-[4-methoxy-3-[[[4-(1-pyrazolyl)phenyl]methylthio]methyl]phenyl]ethanone IUPAC Name: 1-[4-methoxy-3-[(4-pyrazol-1-ylphenyl)methylsulfanylmethyl]phenyl]ethanone Traditional Name: 1-[4-methoxy-3-[[(4-pyrazol-1-ylbenzyl)thio]methyl]phenyl]ethanone Formula: C20H20N2O2S MolecularWeight: 352.45

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)C1=CC(=C(C=C1)OC)CSCC2=CC=C(C=C2)N3C=CC=N3

Isomeric SMILES

CC(=O)C1=CC(=C(C=C1)OC)CSCC2=CC=C(C=C2)N3C=CC=N3

InChI

InChI=1S/C20H20N2O2S/c1-15(23)17-6-9-20(24-2)18(12-17)14-25-13-16-4-7-19(8-5-16)22-11-3-10-21-22/h3-12H,13-14H2,1-2H3