3-(azepan-1-ylsulfonyl)-4-chloranyl-N-(2-methyl-2-morpholin-4-yl-propyl)benzamide

Systemtic Name: 3-(azepan-1-ylsulfonyl)-4-chloranyl-N-(2-methyl-2-morpholin-4-yl-propyl)benzamide Openeye Name: 3-(azepan-1-ylsulfonyl)-4-chloro-N-(2-methyl-2-morpholino-propyl)benzamide CAS Name: 3-(1-azepanylsulfonyl)-4-chloro-N-[2-methyl-2-(4-morpholinyl)propyl]benzamide IUPAC Name: 3-(azepan-1-ylsulfonyl)-4-chloro-N-(2-methyl-2-morpholin-4-ylpropyl)benzamide Traditional Name: 3-(azepan-1-ylsulfonyl)-4-chloro-N-(2-methyl-2-morpholino-propyl)benzamide Formula: C21H32ClN3O4S MolecularWeight: 458.01448

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(CNC(=O)C1=CC(=C(C=C1)Cl)S(=O)(=O)N2CCCCCC2)N3CCOCC3

Isomeric SMILES

CC(C)(CNC(=O)C1=CC(=C(C=C1)Cl)S(=O)(=O)N2CCCCCC2)N3CCOCC3

InChI

InChI=1S/C21H32ClN3O4S/c1-21(2,24-11-13-29-14-12-24)16-23-20(26)17-7-8-18(22)19(15-17)30(27,28)25-9-5-3-4-6-10-25/h7-8,15H,3-6,9-14,16H2,1-2H3,(H,23,26)