1-[1-(4-methoxyphenyl)-2,5-dimethyl-pyrrol-3-yl]-2-naphthalen-2-ylsulfanyl-ethanone

Systemtic Name: 1-[1-(4-methoxyphenyl)-2,5-dimethyl-pyrrol-3-yl]-2-naphthalen-2-ylsulfanyl-ethanone Openeye Name: 1-[1-(4-methoxyphenyl)-2,5-dimethyl-pyrrol-3-yl]-2-(2-naphthylsulfanyl)ethanone CAS Name: 1-[1-(4-methoxyphenyl)-2,5-dimethyl-3-pyrrolyl]-2-(2-naphthalenylthio)ethanone IUPAC Name: 1-[1-(4-methoxyphenyl)-2,5-dimethylpyrrol-3-yl]-2-naphthalen-2-ylsulfanylethanone Traditional Name: 1-[1-(4-methoxyphenyl)-2,5-dimethyl-pyrrol-3-yl]-2-(2-naphthylthio)ethanone Formula: C25H23NO2S MolecularWeight: 401.52062

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(N1C2=CC=C(C=C2)OC)C)C(=O)CSC3=CC4=CC=CC=C4C=C3

Isomeric SMILES

CC1=CC(=C(N1C2=CC=C(C=C2)OC)C)C(=O)CSC3=CC4=CC=CC=C4C=C3

InChI

InChI=1S/C25H23NO2S/c1-17-14-24(18(2)26(17)21-9-11-22(28-3)12-10-21)25(27)16-29-23-13-8-19-6-4-5-7-20(19)15-23/h4-15H,16H2,1-3H3