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

Systemtic Name: [4-(2,1,3-benzothiadiazol-4-ylsulfonyl)piperazin-1-yl]-(3-chloranyl-4-ethoxy-5-methoxy-phenyl)methanone Openeye Name: [4-(2,1,3-benzothiadiazol-4-ylsulfonyl)piperazin-1-yl]-(3-chloro-4-ethoxy-5-methoxy-phenyl)methanone CAS Name: [4-(2,1,3-benzothiadiazol-4-ylsulfonyl)-1-piperazinyl]-(3-chloro-4-ethoxy-5-methoxyphenyl)methanone IUPAC Name: [4-(2,1,3-benzothiadiazol-4-ylsulfonyl)piperazin-1-yl]-(3-chloro-4-ethoxy-5-methoxyphenyl)methanone Traditional Name: (3-chloro-4-ethoxy-5-methoxy-phenyl)-(4-piazthiol-4-ylsulfonylpiperazino)methanone Formula: C20H21ClN4O5S2 MolecularWeight: 496.98754

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C=C(C=C1Cl)C(=O)N2CCN(CC2)S(=O)(=O)C3=CC=CC4=NSN=C43)OC

Isomeric SMILES

CCOC1=C(C=C(C=C1Cl)C(=O)N2CCN(CC2)S(=O)(=O)C3=CC=CC4=NSN=C43)OC

InChI

InChI=1S/C20H21ClN4O5S2/c1-3-30-19-14(21)11-13(12-16(19)29-2)20(26)24-7-9-25(10-8-24)32(27,28)17-6-4-5-15-18(17)23-31-22-15/h4-6,11-12H,3,7-10H2,1-2H3