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

Systemtic Name: 4-(azepan-1-ylcarbonyl)-N-[2-(4-chlorophenyl)ethyl]-1,2,5-trimethyl-pyrrole-3-sulfonamide Openeye Name: 4-(azepane-1-carbonyl)-N-[2-(4-chlorophenyl)ethyl]-1,2,5-trimethyl-pyrrole-3-sulfonamide CAS Name: 4-[1-azepanyl(oxo)methyl]-N-[2-(4-chlorophenyl)ethyl]-1,2,5-trimethyl-3-pyrrolesulfonamide IUPAC Name: 4-(azepane-1-carbonyl)-N-[2-(4-chlorophenyl)ethyl]-1,2,5-trimethylpyrrole-3-sulfonamide Traditional Name: 4-(azepane-1-carbonyl)-N-[2-(4-chlorophenyl)ethyl]-1,2,5-trimethyl-pyrrole-3-sulfonamide Formula: C22H30ClN3O3S MolecularWeight: 452.0099

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=C(N1C)C)S(=O)(=O)NCCC2=CC=C(C=C2)Cl)C(=O)N3CCCCCC3

Isomeric SMILES

CC1=C(C(=C(N1C)C)S(=O)(=O)NCCC2=CC=C(C=C2)Cl)C(=O)N3CCCCCC3

InChI

InChI=1S/C22H30ClN3O3S/c1-16-20(22(27)26-14-6-4-5-7-15-26)21(17(2)25(16)3)30(28,29)24-13-12-18-8-10-19(23)11-9-18/h8-11,24H,4-7,12-15H2,1-3H3