4-[2-(5-methylthiophen-2-yl)azepan-1-yl]sulfonyl-2,1,3-benzothiadiazole

Systemtic Name: 4-[2-(5-methylthiophen-2-yl)azepan-1-yl]sulfonyl-2,1,3-benzothiadiazole Openeye Name: 4-[2-(5-methyl-2-thienyl)azepan-1-yl]sulfonyl-2,1,3-benzothiadiazole CAS Name: 4-[[2-(5-methyl-2-thiophenyl)-1-azepanyl]sulfonyl]-2,1,3-benzothiadiazole IUPAC Name: 4-[2-(5-methylthiophen-2-yl)azepan-1-yl]sulfonyl-2,1,3-benzothiadiazole Traditional Name: 4-[2-(5-methyl-2-thienyl)azepan-1-yl]sulfonylpiazthiole Formula: C17H19N3O2S3 MolecularWeight: 393.54666

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(S1)C2CCCCCN2S(=O)(=O)C3=CC=CC4=NSN=C43

Isomeric SMILES

CC1=CC=C(S1)C2CCCCCN2S(=O)(=O)C3=CC=CC4=NSN=C43

InChI

InChI=1S/C17H19N3O2S3/c1-12-9-10-15(23-12)14-7-3-2-4-11-20(14)25(21,22)16-8-5-6-13-17(16)19-24-18-13/h5-6,8-10,14H,2-4,7,11H2,1H3