1-[2-(4-bromophenyl)sulfonylethyl]-4-(phenylmethyl)-1,4-diazepane

Systemtic Name: 1-[2-(4-bromophenyl)sulfonylethyl]-4-(phenylmethyl)-1,4-diazepane Openeye Name: 1-benzyl-4-[2-(4-bromophenyl)sulfonylethyl]-1,4-diazepane CAS Name: 1-[2-(4-bromophenyl)sulfonylethyl]-4-(phenylmethyl)-1,4-diazepane IUPAC Name: 1-benzyl-4-[2-(4-bromophenyl)sulfonylethyl]-1,4-diazepane Traditional Name: 1-benzyl-4-(2-brosylethyl)-1,4-diazepane Formula: C20H25BrN2O2S MolecularWeight: 437.3937

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN(C1)CC2=CC=CC=C2)CCS(=O)(=O)C3=CC=C(C=C3)Br

Isomeric SMILES

C1CN(CCN(C1)CC2=CC=CC=C2)CCS(=O)(=O)C3=CC=C(C=C3)Br

InChI

InChI=1S/C20H25BrN2O2S/c21-19-7-9-20(10-8-19)26(24,25)16-15-22-11-4-12-23(14-13-22)17-18-5-2-1-3-6-18/h1-3,5-10H,4,11-17H2