4-[3-[4-(azepan-1-ylsulfonyl)phenyl]propanoylamino]-N-methyl-benzamide

Systemtic Name: 4-[3-[4-(azepan-1-ylsulfonyl)phenyl]propanoylamino]-N-methyl-benzamide Openeye Name: 4-[3-[4-(azepan-1-ylsulfonyl)phenyl]propanoylamino]-N-methyl-benzamide CAS Name: 4-[[3-[4-(1-azepanylsulfonyl)phenyl]-1-oxopropyl]amino]-N-methylbenzamide IUPAC Name: 4-[3-[4-(azepan-1-ylsulfonyl)phenyl]propanoylamino]-N-methylbenzamide Traditional Name: 4-[3-[4-(azepan-1-ylsulfonyl)phenyl]propanoylamino]-N-methyl-benzamide Formula: C23H29N3O4S MolecularWeight: 443.55906

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Descriptors Computed from Structure

Canonical SMILES:

CNC(=O)C1=CC=C(C=C1)NC(=O)CCC2=CC=C(C=C2)S(=O)(=O)N3CCCCCC3

Isomeric SMILES

CNC(=O)C1=CC=C(C=C1)NC(=O)CCC2=CC=C(C=C2)S(=O)(=O)N3CCCCCC3

InChI

InChI=1S/C23H29N3O4S/c1-24-23(28)19-9-11-20(12-10-19)25-22(27)15-8-18-6-13-21(14-7-18)31(29,30)26-16-4-2-3-5-17-26/h6-7,9-14H,2-5,8,15-17H2,1H3,(H,24,28)(H,25,27)