1-[4-[[4-(phenylmethyl)-1,4-diazepan-1-yl]sulfonyl]phenyl]ethanone

Systemtic Name: 1-[4-[[4-(phenylmethyl)-1,4-diazepan-1-yl]sulfonyl]phenyl]ethanone Openeye Name: 1-[4-[(4-benzyl-1,4-diazepan-1-yl)sulfonyl]phenyl]ethanone CAS Name: 1-[4-[[4-(phenylmethyl)-1,4-diazepan-1-yl]sulfonyl]phenyl]ethanone IUPAC Name: 1-[4-[(4-benzyl-1,4-diazepan-1-yl)sulfonyl]phenyl]ethanone Traditional Name: 1-[4-[(4-benzyl-1,4-diazepan-1-yl)sulfonyl]phenyl]ethanone Formula: C20H24N2O3S MolecularWeight: 372.48116

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)C1=CC=C(C=C1)S(=O)(=O)N2CCCN(CC2)CC3=CC=CC=C3

Isomeric SMILES

CC(=O)C1=CC=C(C=C1)S(=O)(=O)N2CCCN(CC2)CC3=CC=CC=C3

InChI

InChI=1S/C20H24N2O3S/c1-17(23)19-8-10-20(11-9-19)26(24,25)22-13-5-12-21(14-15-22)16-18-6-3-2-4-7-18/h2-4,6-11H,5,12-16H2,1H3