2-[4-(4-bromophenyl)sulfonyl-1,4-diazepan-1-yl]-N-(2-ethoxyphenyl)ethanamide

Systemtic Name: 2-[4-(4-bromophenyl)sulfonyl-1,4-diazepan-1-yl]-N-(2-ethoxyphenyl)ethanamide Openeye Name: 2-[4-(4-bromophenyl)sulfonyl-1,4-diazepan-1-yl]-N-(2-ethoxyphenyl)acetamide CAS Name: 2-[4-(4-bromophenyl)sulfonyl-1,4-diazepan-1-yl]-N-(2-ethoxyphenyl)acetamide IUPAC Name: 2-[4-(4-bromophenyl)sulfonyl-1,4-diazepan-1-yl]-N-(2-ethoxyphenyl)acetamide Traditional Name: 2-(4-brosyl-1,4-diazepan-1-yl)-N-o-phenetyl-acetamide Formula: C21H26BrN3O4S MolecularWeight: 496.41784

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=CC=C1NC(=O)CN2CCCN(CC2)S(=O)(=O)C3=CC=C(C=C3)Br

Isomeric SMILES

CCOC1=CC=CC=C1NC(=O)CN2CCCN(CC2)S(=O)(=O)C3=CC=C(C=C3)Br

InChI

InChI=1S/C21H26BrN3O4S/c1-2-29-20-7-4-3-6-19(20)23-21(26)16-24-12-5-13-25(15-14-24)30(27,28)18-10-8-17(22)9-11-18/h3-4,6-11H,2,5,12-16H2,1H3,(H,23,26)