N-[4-(azepan-1-ylsulfonyl)phenyl]-4-(propanoylamino)benzamide

Systemtic Name: N-[4-(azepan-1-ylsulfonyl)phenyl]-4-(propanoylamino)benzamide Openeye Name: N-[4-(azepan-1-ylsulfonyl)phenyl]-4-(propanoylamino)benzamide CAS Name: N-[4-(1-azepanylsulfonyl)phenyl]-4-(1-oxopropylamino)benzamide IUPAC Name: N-[4-(azepan-1-ylsulfonyl)phenyl]-4-(propanoylamino)benzamide Traditional Name: N-[4-(azepan-1-ylsulfonyl)phenyl]-4-propionamido-benzamide Formula: C22H27N3O4S MolecularWeight: 429.53248

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Descriptors Computed from Structure

Canonical SMILES:

CCC(=O)NC1=CC=C(C=C1)C(=O)NC2=CC=C(C=C2)S(=O)(=O)N3CCCCCC3

Isomeric SMILES

CCC(=O)NC1=CC=C(C=C1)C(=O)NC2=CC=C(C=C2)S(=O)(=O)N3CCCCCC3

InChI

InChI=1S/C22H27N3O4S/c1-2-21(26)23-18-9-7-17(8-10-18)22(27)24-19-11-13-20(14-12-19)30(28,29)25-15-5-3-4-6-16-25/h7-14H,2-6,15-16H2,1H3,(H,23,26)(H,24,27)