(3,5-ditert-butyl-4-oxidanyl-phenyl)-(1-ethyl-5-methylsulfanyl-pyrrol-3-yl)methanone

Systemtic Name: (3,5-ditert-butyl-4-oxidanyl-phenyl)-(1-ethyl-5-methylsulfanyl-pyrrol-3-yl)methanone Openeye Name: (3,5-ditert-butyl-4-hydroxy-phenyl)-(1-ethyl-5-methylsulfanyl-pyrrol-3-yl)methanone CAS Name: (3,5-ditert-butyl-4-hydroxyphenyl)-[1-ethyl-5-(methylthio)-3-pyrrolyl]methanone IUPAC Name: (3,5-ditert-butyl-4-hydroxyphenyl)-(1-ethyl-5-methylsulfanylpyrrol-3-yl)methanone Traditional Name: (3,5-ditert-butyl-4-hydroxy-phenyl)-[1-ethyl-5-(methylthio)pyrrol-3-yl]methanone Formula: C22H31NO2S MolecularWeight: 373.55204

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C=C(C=C1SC)C(=O)C2=CC(=C(C(=C2)C(C)(C)C)O)C(C)(C)C

Isomeric SMILES

CCN1C=C(C=C1SC)C(=O)C2=CC(=C(C(=C2)C(C)(C)C)O)C(C)(C)C

InChI

InChI=1S/C22H31NO2S/c1-9-23-13-15(12-18(23)26-8)19(24)14-10-16(21(2,3)4)20(25)17(11-14)22(5,6)7/h10-13,25H,9H2,1-8H3