2-(phenylsulfonyl)-1-[4-(pyridin-2-ylmethyl)-1,4-diazepan-1-yl]ethanone

Systemtic Name: 2-(phenylsulfonyl)-1-[4-(pyridin-2-ylmethyl)-1,4-diazepan-1-yl]ethanone Openeye Name: 2-(benzenesulfonyl)-1-[4-(2-pyridylmethyl)-1,4-diazepan-1-yl]ethanone CAS Name: 2-(benzenesulfonyl)-1-[4-(2-pyridinylmethyl)-1,4-diazepan-1-yl]ethanone IUPAC Name: 2-(benzenesulfonyl)-1-[4-(pyridin-2-ylmethyl)-1,4-diazepan-1-yl]ethanone Traditional Name: 2-besyl-1-[4-(2-pyridylmethyl)-1,4-diazepan-1-yl]ethanone Formula: C19H23N3O3S MolecularWeight: 373.46922

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN(C1)C(=O)CS(=O)(=O)C2=CC=CC=C2)CC3=CC=CC=N3

Isomeric SMILES

C1CN(CCN(C1)C(=O)CS(=O)(=O)C2=CC=CC=C2)CC3=CC=CC=N3

InChI

InChI=1S/C19H23N3O3S/c23-19(16-26(24,25)18-8-2-1-3-9-18)22-12-6-11-21(13-14-22)15-17-7-4-5-10-20-17/h1-5,7-10H,6,11-16H2