4-(azepan-1-ylcarbonyl)-N-ethyl-N-(4-methoxyphenyl)-1,2,5-trimethyl-pyrrole-3-sulfonamide

Systemtic Name: 4-(azepan-1-ylcarbonyl)-N-ethyl-N-(4-methoxyphenyl)-1,2,5-trimethyl-pyrrole-3-sulfonamide Openeye Name: 4-(azepane-1-carbonyl)-N-ethyl-N-(4-methoxyphenyl)-1,2,5-trimethyl-pyrrole-3-sulfonamide CAS Name: 4-[1-azepanyl(oxo)methyl]-N-ethyl-N-(4-methoxyphenyl)-1,2,5-trimethyl-3-pyrrolesulfonamide IUPAC Name: 4-(azepane-1-carbonyl)-N-ethyl-N-(4-methoxyphenyl)-1,2,5-trimethylpyrrole-3-sulfonamide Traditional Name: 4-(azepane-1-carbonyl)-N-ethyl-N-(4-methoxyphenyl)-1,2,5-trimethyl-pyrrole-3-sulfonamide Formula: C23H33N3O4S MolecularWeight: 447.59082

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Descriptors Computed from Structure

Canonical SMILES:

CCN(C1=CC=C(C=C1)OC)S(=O)(=O)C2=C(N(C(=C2C(=O)N3CCCCCC3)C)C)C

Isomeric SMILES

CCN(C1=CC=C(C=C1)OC)S(=O)(=O)C2=C(N(C(=C2C(=O)N3CCCCCC3)C)C)C

InChI

InChI=1S/C23H33N3O4S/c1-6-26(19-11-13-20(30-5)14-12-19)31(28,29)22-18(3)24(4)17(2)21(22)23(27)25-15-9-7-8-10-16-25/h11-14H,6-10,15-16H2,1-5H3