[4-(2,1,3-benzothiadiazol-4-ylsulfonyl)piperazin-1-yl]-(2-chloranyl-5-methylsulfanyl-phenyl)methanone

Systemtic Name: [4-(2,1,3-benzothiadiazol-4-ylsulfonyl)piperazin-1-yl]-(2-chloranyl-5-methylsulfanyl-phenyl)methanone Openeye Name: [4-(2,1,3-benzothiadiazol-4-ylsulfonyl)piperazin-1-yl]-(2-chloro-5-methylsulfanyl-phenyl)methanone CAS Name: [4-(2,1,3-benzothiadiazol-4-ylsulfonyl)-1-piperazinyl]-[2-chloro-5-(methylthio)phenyl]methanone IUPAC Name: [4-(2,1,3-benzothiadiazol-4-ylsulfonyl)piperazin-1-yl]-(2-chloro-5-methylsulfanylphenyl)methanone Traditional Name: [2-chloro-5-(methylthio)phenyl]-(4-piazthiol-4-ylsulfonylpiperazino)methanone Formula: C18H17ClN4O3S3 MolecularWeight: 469.00058

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CSC1=CC(=C(C=C1)Cl)C(=O)N2CCN(CC2)S(=O)(=O)C3=CC=CC4=NSN=C43

Isomeric SMILES

CSC1=CC(=C(C=C1)Cl)C(=O)N2CCN(CC2)S(=O)(=O)C3=CC=CC4=NSN=C43

InChI

InChI=1S/C18H17ClN4O3S3/c1-27-12-5-6-14(19)13(11-12)18(24)22-7-9-23(10-8-22)29(25,26)16-4-2-3-15-17(16)21-28-20-15/h2-6,11H,7-10H2,1H3