4-(1-methyl-5-phenyl-pyrrol-2-yl)-1-methylsulfinyl-butan-2-one

Systemtic Name: 4-(1-methyl-5-phenyl-pyrrol-2-yl)-1-methylsulfinyl-butan-2-one Openeye Name: 4-(1-methyl-5-phenyl-pyrrol-2-yl)-1-methylsulfinyl-butan-2-one CAS Name: 4-(1-methyl-5-phenyl-2-pyrrolyl)-1-methylsulfinyl-2-butanone IUPAC Name: 4-(1-methyl-5-phenylpyrrol-2-yl)-1-methylsulfinylbutan-2-one Traditional Name: 4-(1-methyl-5-phenyl-pyrrol-2-yl)-1-methylsulfinyl-butan-2-one Formula: C16H19NO2S MolecularWeight: 289.39256

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Descriptors Computed from Structure

Canonical SMILES:

CN1C(=CC=C1C2=CC=CC=C2)CCC(=O)CS(=O)C

Isomeric SMILES

CN1C(=CC=C1C2=CC=CC=C2)CCC(=O)CS(=O)C

InChI

InChI=1S/C16H19NO2S/c1-17-14(8-10-15(18)12-20(2)19)9-11-16(17)13-6-4-3-5-7-13/h3-7,9,11H,8,10,12H2,1-2H3