1-(phenylmethyl)sulfonyl-1,4-diazepane

Systemtic Name: 1-(phenylmethyl)sulfonyl-1,4-diazepane Openeye Name: 1-benzylsulfonyl-1,4-diazepane CAS Name: 1-(phenylmethyl)sulfonyl-1,4-diazepane IUPAC Name: 1-benzylsulfonyl-1,4-diazepane Traditional Name: 1-benzylsulfonyl-1,4-diazepane Formula: C12H18N2O2S MolecularWeight: 254.34852

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Descriptors Computed from Structure

Canonical SMILES:

C1CNCCN(C1)S(=O)(=O)CC2=CC=CC=C2

Isomeric SMILES

C1CNCCN(C1)S(=O)(=O)CC2=CC=CC=C2

InChI

InChI=1S/C12H18N2O2S/c15-17(16,11-12-5-2-1-3-6-12)14-9-4-7-13-8-10-14/h1-3,5-6,13H,4,7-11H2