N-[4-(azepan-1-ylsulfonyl)phenyl]-1-methyl-4-pyrrolidin-1-ylsulfonyl-pyrrole-2-carboxamide

Systemtic Name: N-[4-(azepan-1-ylsulfonyl)phenyl]-1-methyl-4-pyrrolidin-1-ylsulfonyl-pyrrole-2-carboxamide Openeye Name: N-[4-(azepan-1-ylsulfonyl)phenyl]-1-methyl-4-pyrrolidin-1-ylsulfonyl-pyrrole-2-carboxamide CAS Name: N-[4-(1-azepanylsulfonyl)phenyl]-1-methyl-4-(1-pyrrolidinylsulfonyl)-2-pyrrolecarboxamide IUPAC Name: N-[4-(azepan-1-ylsulfonyl)phenyl]-1-methyl-4-pyrrolidin-1-ylsulfonylpyrrole-2-carboxamide Traditional Name: N-[4-(azepan-1-ylsulfonyl)phenyl]-1-methyl-4-pyrrolidinosulfonyl-pyrrole-2-carboxamide Formula: C22H30N4O5S2 MolecularWeight: 494.6274

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Descriptors Computed from Structure

Canonical SMILES:

CN1C=C(C=C1C(=O)NC2=CC=C(C=C2)S(=O)(=O)N3CCCCCC3)S(=O)(=O)N4CCCC4

Isomeric SMILES

CN1C=C(C=C1C(=O)NC2=CC=C(C=C2)S(=O)(=O)N3CCCCCC3)S(=O)(=O)N4CCCC4

InChI

InChI=1S/C22H30N4O5S2/c1-24-17-20(33(30,31)26-14-6-7-15-26)16-21(24)22(27)23-18-8-10-19(11-9-18)32(28,29)25-12-4-2-3-5-13-25/h8-11,16-17H,2-7,12-15H2,1H3,(H,23,27)