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

Systemtic Name: 2-[4-(4-bromophenyl)sulfonyl-1,4-diazepan-1-yl]ethanamide Openeye Name: 2-[4-(4-bromophenyl)sulfonyl-1,4-diazepan-1-yl]acetamide CAS Name: 2-[4-(4-bromophenyl)sulfonyl-1,4-diazepan-1-yl]acetamide IUPAC Name: 2-[4-(4-bromophenyl)sulfonyl-1,4-diazepan-1-yl]acetamide Traditional Name: 2-(4-brosyl-1,4-diazepan-1-yl)acetamide Formula: C13H18BrN3O3S MolecularWeight: 376.26932

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN(C1)S(=O)(=O)C2=CC=C(C=C2)Br)CC(=O)N

Isomeric SMILES

C1CN(CCN(C1)S(=O)(=O)C2=CC=C(C=C2)Br)CC(=O)N

InChI

InChI=1S/C13H18BrN3O3S/c14-11-2-4-12(5-3-11)21(19,20)17-7-1-6-16(8-9-17)10-13(15)18/h2-5H,1,6-10H2,(H2,15,18)