1-[4-methoxy-3,5-di(pyrrol-1-yl)phenyl]-2-methylsulfonyl-ethanone

Systemtic Name: 1-[4-methoxy-3,5-di(pyrrol-1-yl)phenyl]-2-methylsulfonyl-ethanone Openeye Name: 1-[4-methoxy-3,5-di(pyrrol-1-yl)phenyl]-2-methylsulfonyl-ethanone CAS Name: 1-[4-methoxy-3,5-bis(1-pyrrolyl)phenyl]-2-methylsulfonylethanone IUPAC Name: 1-[4-methoxy-3,5-di(pyrrol-1-yl)phenyl]-2-methylsulfonylethanone Traditional Name: 2-mesyl-1-[4-methoxy-3,5-di(pyrrol-1-yl)phenyl]ethanone Formula: C18H18N2O4S MolecularWeight: 358.41152

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1N2C=CC=C2)C(=O)CS(=O)(=O)C)N3C=CC=C3

Isomeric SMILES

COC1=C(C=C(C=C1N2C=CC=C2)C(=O)CS(=O)(=O)C)N3C=CC=C3

InChI

InChI=1S/C18H18N2O4S/c1-24-18-15(19-7-3-4-8-19)11-14(17(21)13-25(2,22)23)12-16(18)20-9-5-6-10-20/h3-12H,13H2,1-2H3