3-(azepan-1-ylsulfonyl)-N-[3-(2,2-dimethylpropanoylamino)phenyl]benzamide

Systemtic Name: 3-(azepan-1-ylsulfonyl)-N-[3-(2,2-dimethylpropanoylamino)phenyl]benzamide Openeye Name: 3-(azepan-1-ylsulfonyl)-N-[3-(2,2-dimethylpropanoylamino)phenyl]benzamide CAS Name: 3-(1-azepanylsulfonyl)-N-[3-[(2,2-dimethyl-1-oxopropyl)amino]phenyl]benzamide IUPAC Name: 3-(azepan-1-ylsulfonyl)-N-[3-(2,2-dimethylpropanoylamino)phenyl]benzamide Traditional Name: 3-(azepan-1-ylsulfonyl)-N-[3-(pivaloylamino)phenyl]benzamide Formula: C24H31N3O4S MolecularWeight: 457.58564

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C(=O)NC1=CC=CC(=C1)NC(=O)C2=CC(=CC=C2)S(=O)(=O)N3CCCCCC3

Isomeric SMILES

CC(C)(C)C(=O)NC1=CC=CC(=C1)NC(=O)C2=CC(=CC=C2)S(=O)(=O)N3CCCCCC3

InChI

InChI=1S/C24H31N3O4S/c1-24(2,3)23(29)26-20-12-9-11-19(17-20)25-22(28)18-10-8-13-21(16-18)32(30,31)27-14-6-4-5-7-15-27/h8-13,16-17H,4-7,14-15H2,1-3H3,(H,25,28)(H,26,29)