4-[[(6-chloranyl-3-phenethyl-3,4-dihydro-2H-1,2,4-benzothiadiazin-7-yl)sulfonylamino]methyl]benzoic acid

Systemtic Name: 4-[[(6-chloranyl-3-phenethyl-3,4-dihydro-2H-1,2,4-benzothiadiazin-7-yl)sulfonylamino]methyl]benzoic acid Openeye Name: 4-[[(6-chloro-3-phenethyl-3,4-dihydro-2H-1,2,4-benzothiadiazin-7-yl)sulfonylamino]methyl]benzoic acid CAS Name: 4-[[(6-chloro-3-phenethyl-3,4-dihydro-2H-1,2,4-benzothiadiazin-7-yl)sulfonylamino]methyl]benzoic acid IUPAC Name: 4-[[(6-chloro-3-phenethyl-3,4-dihydro-2H-1,2,4-benzothiadiazin-7-yl)sulfonylamino]methyl]benzoic acid Traditional Name: 4-[[(6-chloro-3-phenethyl-3,4-dihydro-2H-1,2,4-benzothiadiazin-7-yl)sulfonylamino]methyl]benzoic acid Formula: C23H22ClN3O4S2 MolecularWeight: 504.02148

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CCC2NC3=CC(=C(C=C3SN2)S(=O)(=O)NCC4=CC=C(C=C4)C(=O)O)Cl

Isomeric SMILES

C1=CC=C(C=C1)CCC2NC3=CC(=C(C=C3SN2)S(=O)(=O)NCC4=CC=C(C=C4)C(=O)O)Cl

InChI

InChI=1S/C23H22ClN3O4S2/c24-18-12-19-20(32-27-22(26-19)11-8-15-4-2-1-3-5-15)13-21(18)33(30,31)25-14-16-6-9-17(10-7-16)23(28)29/h1-7,9-10,12-13,22,25-27H,8,11,14H2,(H,28,29)