4-(azepan-1-ylcarbonyl)-N-tert-butyl-1,2,5-trimethyl-pyrrole-3-sulfonamide

Systemtic Name: 4-(azepan-1-ylcarbonyl)-N-tert-butyl-1,2,5-trimethyl-pyrrole-3-sulfonamide Openeye Name: 4-(azepane-1-carbonyl)-N-tert-butyl-1,2,5-trimethyl-pyrrole-3-sulfonamide CAS Name: 4-[1-azepanyl(oxo)methyl]-N-tert-butyl-1,2,5-trimethyl-3-pyrrolesulfonamide IUPAC Name: 4-(azepane-1-carbonyl)-N-tert-butyl-1,2,5-trimethylpyrrole-3-sulfonamide Traditional Name: 4-(azepane-1-carbonyl)-N-tert-butyl-1,2,5-trimethyl-pyrrole-3-sulfonamide Formula: C18H31N3O3S MolecularWeight: 369.52204

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=C(N1C)C)S(=O)(=O)NC(C)(C)C)C(=O)N2CCCCCC2

Isomeric SMILES

CC1=C(C(=C(N1C)C)S(=O)(=O)NC(C)(C)C)C(=O)N2CCCCCC2

InChI

InChI=1S/C18H31N3O3S/c1-13-15(17(22)21-11-9-7-8-10-12-21)16(14(2)20(13)6)25(23,24)19-18(3,4)5/h19H,7-12H2,1-6H3