methyl 4-[[[4-(4-methylpiperidin-1-yl)sulfonylphenyl]carbonylamino]sulfamoyl]benzoate

Systemtic Name: methyl 4-[[[4-(4-methylpiperidin-1-yl)sulfonylphenyl]carbonylamino]sulfamoyl]benzoate Openeye Name: methyl 4-[[[4-[(4-methyl-1-piperidyl)sulfonyl]benzoyl]amino]sulfamoyl]benzoate CAS Name: 4-[[[[4-[(4-methyl-1-piperidinyl)sulfonyl]phenyl]-oxomethyl]amino]sulfamoyl]benzoic acid methyl ester IUPAC Name: methyl 4-[[[4-(4-methylpiperidin-1-yl)sulfonylbenzoyl]amino]sulfamoyl]benzoate Traditional Name: 4-[[[4-(4-methylpiperidino)sulfonylbenzoyl]amino]sulfamoyl]benzoic acid methyl ester Formula: C21H25N3O7S2 MolecularWeight: 495.5691

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCN(CC1)S(=O)(=O)C2=CC=C(C=C2)C(=O)NNS(=O)(=O)C3=CC=C(C=C3)C(=O)OC

Isomeric SMILES

CC1CCN(CC1)S(=O)(=O)C2=CC=C(C=C2)C(=O)NNS(=O)(=O)C3=CC=C(C=C3)C(=O)OC

InChI

InChI=1S/C21H25N3O7S2/c1-15-11-13-24(14-12-15)33(29,30)19-9-3-16(4-10-19)20(25)22-23-32(27,28)18-7-5-17(6-8-18)21(26)31-2/h3-10,15,23H,11-14H2,1-2H3,(H,22,25)