3-(azepan-1-ylsulfonyl)-4-methoxy-N-[2-oxidanylidene-2-[(2,4,6-trimethylphenyl)amino]ethyl]benzamide

Systemtic Name: 3-(azepan-1-ylsulfonyl)-4-methoxy-N-[2-oxidanylidene-2-[(2,4,6-trimethylphenyl)amino]ethyl]benzamide Openeye Name: 3-(azepan-1-ylsulfonyl)-4-methoxy-N-[2-oxo-2-(2,4,6-trimethylanilino)ethyl]benzamide CAS Name: 3-(1-azepanylsulfonyl)-4-methoxy-N-[2-oxo-2-(2,4,6-trimethylanilino)ethyl]benzamide IUPAC Name: 3-(azepan-1-ylsulfonyl)-4-methoxy-N-[2-oxo-2-(2,4,6-trimethylanilino)ethyl]benzamide Traditional Name: 3-(azepan-1-ylsulfonyl)-N-(2-keto-2-mesidino-ethyl)-4-methoxy-benzamide Formula: C25H33N3O5S MolecularWeight: 487.61162

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C(=C1)C)NC(=O)CNC(=O)C2=CC(=C(C=C2)OC)S(=O)(=O)N3CCCCCC3)C

Isomeric SMILES

CC1=CC(=C(C(=C1)C)NC(=O)CNC(=O)C2=CC(=C(C=C2)OC)S(=O)(=O)N3CCCCCC3)C

InChI

InChI=1S/C25H33N3O5S/c1-17-13-18(2)24(19(3)14-17)27-23(29)16-26-25(30)20-9-10-21(33-4)22(15-20)34(31,32)28-11-7-5-6-8-12-28/h9-10,13-15H,5-8,11-12,16H2,1-4H3,(H,26,30)(H,27,29)