4-[2-[[4-(azepan-1-ylsulfonyl)phenyl]amino]ethanoylamino]-N,N-dimethyl-benzamide

Systemtic Name: 4-[2-[[4-(azepan-1-ylsulfonyl)phenyl]amino]ethanoylamino]-N,N-dimethyl-benzamide Openeye Name: 4-[[2-[4-(azepan-1-ylsulfonyl)anilino]acetyl]amino]-N,N-dimethyl-benzamide CAS Name: 4-[[2-[4-(1-azepanylsulfonyl)anilino]-1-oxoethyl]amino]-N,N-dimethylbenzamide IUPAC Name: 4-[[2-[4-(azepan-1-ylsulfonyl)anilino]acetyl]amino]-N,N-dimethylbenzamide Traditional Name: 4-[[2-[4-(azepan-1-ylsulfonyl)anilino]acetyl]amino]-N,N-dimethyl-benzamide Formula: C23H30N4O4S MolecularWeight: 458.5737

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Descriptors Computed from Structure

Canonical SMILES:

CN(C)C(=O)C1=CC=C(C=C1)NC(=O)CNC2=CC=C(C=C2)S(=O)(=O)N3CCCCCC3

Isomeric SMILES

CN(C)C(=O)C1=CC=C(C=C1)NC(=O)CNC2=CC=C(C=C2)S(=O)(=O)N3CCCCCC3

InChI

InChI=1S/C23H30N4O4S/c1-26(2)23(29)18-7-9-20(10-8-18)25-22(28)17-24-19-11-13-21(14-12-19)32(30,31)27-15-5-3-4-6-16-27/h7-14,24H,3-6,15-17H2,1-2H3,(H,25,28)