2-[5-(phenylmethyl)-1,5-diazocan-1-yl]-1,3-benzothiazole 1,1-dioxide

Systemtic Name: 2-[5-(phenylmethyl)-1,5-diazocan-1-yl]-1,3-benzothiazole 1,1-dioxide Openeye Name: 2-(5-benzyl-1,5-diazocan-1-yl)-1,3-benzothiazole 1,1-dioxide CAS Name: 2-[5-(phenylmethyl)-1,5-diazocan-1-yl]-1,3-benzothiazole 1,1-dioxide IUPAC Name: 2-(5-benzyl-1,5-diazocan-1-yl)-1,3-benzothiazole 1,1-dioxide Traditional Name: 2-(5-benzyl-1,5-diazocan-1-yl)-1,3-benzothiazole 1,1-dioxide Formula: C20H23N3O2S MolecularWeight: 369.48052

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCCN(C1)C2=NC3=CC=CC=C3S2(=O)=O)CC4=CC=CC=C4

Isomeric SMILES

C1CN(CCCN(C1)C2=NC3=CC=CC=C3S2(=O)=O)CC4=CC=CC=C4

InChI

InChI=1S/C20H23N3O2S/c24-26(25)19-11-5-4-10-18(19)21-20(26)23-14-6-12-22(13-7-15-23)16-17-8-2-1-3-9-17/h1-5,8-11H,6-7,12-16H2