4-(azepan-1-ylcarbonyl)-N-[(2,5-dimethoxyphenyl)methyl]-1,2,5-trimethyl-pyrrole-3-sulfonamide

Systemtic Name: 4-(azepan-1-ylcarbonyl)-N-[(2,5-dimethoxyphenyl)methyl]-1,2,5-trimethyl-pyrrole-3-sulfonamide Openeye Name: 4-(azepane-1-carbonyl)-N-[(2,5-dimethoxyphenyl)methyl]-1,2,5-trimethyl-pyrrole-3-sulfonamide CAS Name: 4-[1-azepanyl(oxo)methyl]-N-[(2,5-dimethoxyphenyl)methyl]-1,2,5-trimethyl-3-pyrrolesulfonamide IUPAC Name: 4-(azepane-1-carbonyl)-N-[(2,5-dimethoxyphenyl)methyl]-1,2,5-trimethylpyrrole-3-sulfonamide Traditional Name: 4-(azepane-1-carbonyl)-N-(2,5-dimethoxybenzyl)-1,2,5-trimethyl-pyrrole-3-sulfonamide Formula: C23H33N3O5S MolecularWeight: 463.59022

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=C(N1C)C)S(=O)(=O)NCC2=C(C=CC(=C2)OC)OC)C(=O)N3CCCCCC3

Isomeric SMILES

CC1=C(C(=C(N1C)C)S(=O)(=O)NCC2=C(C=CC(=C2)OC)OC)C(=O)N3CCCCCC3

InChI

InChI=1S/C23H33N3O5S/c1-16-21(23(27)26-12-8-6-7-9-13-26)22(17(2)25(16)3)32(28,29)24-15-18-14-19(30-4)10-11-20(18)31-5/h10-11,14,24H,6-9,12-13,15H2,1-5H3