4-(azepan-1-ylcarbonyl)-1,2,5-trimethyl-N-(4-propan-2-ylphenyl)pyrrole-3-sulfonamide

Systemtic Name: 4-(azepan-1-ylcarbonyl)-1,2,5-trimethyl-N-(4-propan-2-ylphenyl)pyrrole-3-sulfonamide Openeye Name: 4-(azepane-1-carbonyl)-N-(4-isopropylphenyl)-1,2,5-trimethyl-pyrrole-3-sulfonamide CAS Name: 4-[1-azepanyl(oxo)methyl]-1,2,5-trimethyl-N-(4-propan-2-ylphenyl)-3-pyrrolesulfonamide IUPAC Name: 4-(azepane-1-carbonyl)-1,2,5-trimethyl-N-(4-propan-2-ylphenyl)pyrrole-3-sulfonamide Traditional Name: 4-(azepane-1-carbonyl)-1,2,5-trimethyl-N-p-cumenyl-pyrrole-3-sulfonamide Formula: C23H33N3O3S MolecularWeight: 431.59142

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=C(N1C)C)S(=O)(=O)NC2=CC=C(C=C2)C(C)C)C(=O)N3CCCCCC3

Isomeric SMILES

CC1=C(C(=C(N1C)C)S(=O)(=O)NC2=CC=C(C=C2)C(C)C)C(=O)N3CCCCCC3

InChI

InChI=1S/C23H33N3O3S/c1-16(2)19-10-12-20(13-11-19)24-30(28,29)22-18(4)25(5)17(3)21(22)23(27)26-14-8-6-7-9-15-26/h10-13,16,24H,6-9,14-15H2,1-5H3