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

Systemtic Name: (3,5-ditert-butyl-4-oxidanyl-phenyl)-(5-methylsulfinyl-1H-pyrrol-3-yl)methanone Openeye Name: (3,5-ditert-butyl-4-hydroxy-phenyl)-(5-methylsulfinyl-1H-pyrrol-3-yl)methanone CAS Name: (3,5-ditert-butyl-4-hydroxyphenyl)-(5-methylsulfinyl-1H-pyrrol-3-yl)methanone IUPAC Name: (3,5-ditert-butyl-4-hydroxyphenyl)-(5-methylsulfinyl-1H-pyrrol-3-yl)methanone Traditional Name: (3,5-ditert-butyl-4-hydroxy-phenyl)-(5-methylsulfinyl-1H-pyrrol-3-yl)methanone Formula: C20H27NO3S MolecularWeight: 361.49828

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=CC(=CC(=C1O)C(C)(C)C)C(=O)C2=CNC(=C2)S(=O)C

Isomeric SMILES

CC(C)(C)C1=CC(=CC(=C1O)C(C)(C)C)C(=O)C2=CNC(=C2)S(=O)C

InChI

InChI=1S/C20H27NO3S/c1-19(2,3)14-8-12(9-15(18(14)23)20(4,5)6)17(22)13-10-16(21-11-13)25(7)24/h8-11,21,23H,1-7H3