4-(azepan-1-ylcarbonyl)-N-(5-chloranylpyridin-2-yl)-1,2,5-trimethyl-pyrrole-3-sulfonamide

Systemtic Name: 4-(azepan-1-ylcarbonyl)-N-(5-chloranylpyridin-2-yl)-1,2,5-trimethyl-pyrrole-3-sulfonamide Openeye Name: 4-(azepane-1-carbonyl)-N-(5-chloro-2-pyridyl)-1,2,5-trimethyl-pyrrole-3-sulfonamide CAS Name: 4-[1-azepanyl(oxo)methyl]-N-(5-chloro-2-pyridinyl)-1,2,5-trimethyl-3-pyrrolesulfonamide IUPAC Name: 4-(azepane-1-carbonyl)-N-(5-chloropyridin-2-yl)-1,2,5-trimethylpyrrole-3-sulfonamide Traditional Name: 4-(azepane-1-carbonyl)-N-(5-chloro-2-pyridyl)-1,2,5-trimethyl-pyrrole-3-sulfonamide Formula: C19H25ClN4O3S MolecularWeight: 424.9448

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=C(N1C)C)S(=O)(=O)NC2=NC=C(C=C2)Cl)C(=O)N3CCCCCC3

Isomeric SMILES

CC1=C(C(=C(N1C)C)S(=O)(=O)NC2=NC=C(C=C2)Cl)C(=O)N3CCCCCC3

InChI

InChI=1S/C19H25ClN4O3S/c1-13-17(19(25)24-10-6-4-5-7-11-24)18(14(2)23(13)3)28(26,27)22-16-9-8-15(20)12-21-16/h8-9,12H,4-7,10-11H2,1-3H3,(H,21,22)