2-[4-(4-bromanyl-2-chloranyl-phenyl)sulfonyl-1,4-diazepan-1-yl]-N,N-diethyl-ethanamide

Systemtic Name: 2-[4-(4-bromanyl-2-chloranyl-phenyl)sulfonyl-1,4-diazepan-1-yl]-N,N-diethyl-ethanamide Openeye Name: 2-[4-(4-bromo-2-chloro-phenyl)sulfonyl-1,4-diazepan-1-yl]-N,N-diethyl-acetamide CAS Name: 2-[4-(4-bromo-2-chlorophenyl)sulfonyl-1,4-diazepan-1-yl]-N,N-diethylacetamide IUPAC Name: 2-[4-(4-bromo-2-chlorophenyl)sulfonyl-1,4-diazepan-1-yl]-N,N-diethylacetamide Traditional Name: 2-[4-(4-bromo-2-chloro-phenyl)sulfonyl-1,4-diazepan-1-yl]-N,N-diethyl-acetamide Formula: C17H25BrClN3O3S MolecularWeight: 466.8207

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)C(=O)CN1CCCN(CC1)S(=O)(=O)C2=C(C=C(C=C2)Br)Cl

Isomeric SMILES

CCN(CC)C(=O)CN1CCCN(CC1)S(=O)(=O)C2=C(C=C(C=C2)Br)Cl

InChI

InChI=1S/C17H25BrClN3O3S/c1-3-21(4-2)17(23)13-20-8-5-9-22(11-10-20)26(24,25)16-7-6-14(18)12-15(16)19/h6-7,12H,3-5,8-11,13H2,1-2H3