1-(5-aminocarbonyl-1-methyl-pyrrol-3-yl)sulfonyl-N-(5-tert-butyl-2-oxidanyl-phenyl)piperidine-4-carboxamide

Systemtic Name: 1-(5-aminocarbonyl-1-methyl-pyrrol-3-yl)sulfonyl-N-(5-tert-butyl-2-oxidanyl-phenyl)piperidine-4-carboxamide Openeye Name: N-(5-tert-butyl-2-hydroxy-phenyl)-1-(5-carbamoyl-1-methyl-pyrrol-3-yl)sulfonyl-piperidine-4-carboxamide CAS Name: N-(5-tert-butyl-2-hydroxyphenyl)-1-[(5-carbamoyl-1-methyl-3-pyrrolyl)sulfonyl]-4-piperidinecarboxamide IUPAC Name: N-(5-tert-butyl-2-hydroxyphenyl)-1-(5-carbamoyl-1-methylpyrrol-3-yl)sulfonylpiperidine-4-carboxamide Traditional Name: N-(5-tert-butyl-2-hydroxy-phenyl)-1-(5-carbamoyl-1-methyl-pyrrol-3-yl)sulfonyl-isonipecotamide Formula: C22H30N4O5S MolecularWeight: 462.5624

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=CC(=C(C=C1)O)NC(=O)C2CCN(CC2)S(=O)(=O)C3=CN(C(=C3)C(=O)N)C

Isomeric SMILES

CC(C)(C)C1=CC(=C(C=C1)O)NC(=O)C2CCN(CC2)S(=O)(=O)C3=CN(C(=C3)C(=O)N)C

InChI

InChI=1S/C22H30N4O5S/c1-22(2,3)15-5-6-19(27)17(11-15)24-21(29)14-7-9-26(10-8-14)32(30,31)16-12-18(20(23)28)25(4)13-16/h5-6,11-14,27H,7-10H2,1-4H3,(H2,23,28)(H,24,29)