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

Systemtic Name: 4-[2-(2-chlorophenyl)azepan-1-yl]sulfonyl-2,1,3-benzothiadiazole Openeye Name: 4-[2-(2-chlorophenyl)azepan-1-yl]sulfonyl-2,1,3-benzothiadiazole CAS Name: 4-[[2-(2-chlorophenyl)-1-azepanyl]sulfonyl]-2,1,3-benzothiadiazole IUPAC Name: 4-[2-(2-chlorophenyl)azepan-1-yl]sulfonyl-2,1,3-benzothiadiazole Traditional Name: 4-[2-(2-chlorophenyl)azepan-1-yl]sulfonylpiazthiole Formula: C18H18ClN3O2S2 MolecularWeight: 407.93742

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(N(CC1)S(=O)(=O)C2=CC=CC3=NSN=C32)C4=CC=CC=C4Cl

Isomeric SMILES

C1CCC(N(CC1)S(=O)(=O)C2=CC=CC3=NSN=C32)C4=CC=CC=C4Cl

InChI

InChI=1S/C18H18ClN3O2S2/c19-14-8-4-3-7-13(14)16-10-2-1-5-12-22(16)26(23,24)17-11-6-9-15-18(17)21-25-20-15/h3-4,6-9,11,16H,1-2,5,10,12H2