4-(azepan-1-ylcarbonyl)-N-(furan-2-ylmethyl)-1,2,5-trimethyl-pyrrole-3-sulfonamide

Systemtic Name: 4-(azepan-1-ylcarbonyl)-N-(furan-2-ylmethyl)-1,2,5-trimethyl-pyrrole-3-sulfonamide Openeye Name: 4-(azepane-1-carbonyl)-N-(2-furylmethyl)-1,2,5-trimethyl-pyrrole-3-sulfonamide CAS Name: 4-[1-azepanyl(oxo)methyl]-N-(2-furanylmethyl)-1,2,5-trimethyl-3-pyrrolesulfonamide IUPAC Name: 4-(azepane-1-carbonyl)-N-(furan-2-ylmethyl)-1,2,5-trimethylpyrrole-3-sulfonamide Traditional Name: 4-(azepane-1-carbonyl)-N-(2-furfuryl)-1,2,5-trimethyl-pyrrole-3-sulfonamide Formula: C19H27N3O4S MolecularWeight: 393.50038

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=C(N1C)C)S(=O)(=O)NCC2=CC=CO2)C(=O)N3CCCCCC3

Isomeric SMILES

CC1=C(C(=C(N1C)C)S(=O)(=O)NCC2=CC=CO2)C(=O)N3CCCCCC3

InChI

InChI=1S/C19H27N3O4S/c1-14-17(19(23)22-10-6-4-5-7-11-22)18(15(2)21(14)3)27(24,25)20-13-16-9-8-12-26-16/h8-9,12,20H,4-7,10-11,13H2,1-3H3