4-(azepan-1-ylsulfonyl)-N-(3-chloranyl-4-methoxy-phenyl)-1-methyl-pyrrole-2-carboxamide

Systemtic Name: 4-(azepan-1-ylsulfonyl)-N-(3-chloranyl-4-methoxy-phenyl)-1-methyl-pyrrole-2-carboxamide Openeye Name: 4-(azepan-1-ylsulfonyl)-N-(3-chloro-4-methoxy-phenyl)-1-methyl-pyrrole-2-carboxamide CAS Name: 4-(1-azepanylsulfonyl)-N-(3-chloro-4-methoxyphenyl)-1-methyl-2-pyrrolecarboxamide IUPAC Name: 4-(azepan-1-ylsulfonyl)-N-(3-chloro-4-methoxyphenyl)-1-methylpyrrole-2-carboxamide Traditional Name: 4-(azepan-1-ylsulfonyl)-N-(3-chloro-4-methoxy-phenyl)-1-methyl-pyrrole-2-carboxamide Formula: C19H24ClN3O4S MolecularWeight: 425.92956

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Descriptors Computed from Structure

Canonical SMILES:

CN1C=C(C=C1C(=O)NC2=CC(=C(C=C2)OC)Cl)S(=O)(=O)N3CCCCCC3

Isomeric SMILES

CN1C=C(C=C1C(=O)NC2=CC(=C(C=C2)OC)Cl)S(=O)(=O)N3CCCCCC3

InChI

InChI=1S/C19H24ClN3O4S/c1-22-13-15(28(25,26)23-9-5-3-4-6-10-23)12-17(22)19(24)21-14-7-8-18(27-2)16(20)11-14/h7-8,11-13H,3-6,9-10H2,1-2H3,(H,21,24)