(3,5-ditert-butyl-4-oxidanyl-phenyl)-(5-ethylsulfinyl-1H-pyrrol-3-yl)methanone

Systemtic Name: (3,5-ditert-butyl-4-oxidanyl-phenyl)-(5-ethylsulfinyl-1H-pyrrol-3-yl)methanone Openeye Name: (3,5-ditert-butyl-4-hydroxy-phenyl)-(5-ethylsulfinyl-1H-pyrrol-3-yl)methanone CAS Name: (3,5-ditert-butyl-4-hydroxyphenyl)-(5-ethylsulfinyl-1H-pyrrol-3-yl)methanone IUPAC Name: (3,5-ditert-butyl-4-hydroxyphenyl)-(5-ethylsulfinyl-1H-pyrrol-3-yl)methanone Traditional Name: (3,5-ditert-butyl-4-hydroxy-phenyl)-(5-ethylsulfinyl-1H-pyrrol-3-yl)methanone Formula: C21H29NO3S MolecularWeight: 375.52486

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Descriptors Computed from Structure

Canonical SMILES:

CCS(=O)C1=CC(=CN1)C(=O)C2=CC(=C(C(=C2)C(C)(C)C)O)C(C)(C)C

Isomeric SMILES

CCS(=O)C1=CC(=CN1)C(=O)C2=CC(=C(C(=C2)C(C)(C)C)O)C(C)(C)C

InChI

InChI=1S/C21H29NO3S/c1-8-26(25)17-11-14(12-22-17)18(23)13-9-15(20(2,3)4)19(24)16(10-13)21(5,6)7/h9-12,22,24H,8H2,1-7H3