5-[(3,4-dimethoxyphenyl)sulfonylamino]-6-(4-ethylpiperazin-1-yl)pyridine-3-carboxylic acid

Systemtic Name: 5-[(3,4-dimethoxyphenyl)sulfonylamino]-6-(4-ethylpiperazin-1-yl)pyridine-3-carboxylic acid Openeye Name: 5-[(3,4-dimethoxyphenyl)sulfonylamino]-6-(4-ethylpiperazin-1-yl)pyridine-3-carboxylic acid CAS Name: 5-[(3,4-dimethoxyphenyl)sulfonylamino]-6-(4-ethyl-1-piperazinyl)-3-pyridinecarboxylic acid IUPAC Name: 5-[(3,4-dimethoxyphenyl)sulfonylamino]-6-(4-ethylpiperazin-1-yl)pyridine-3-carboxylic acid Traditional Name: 5-[(3,4-dimethoxyphenyl)sulfonylamino]-6-(4-ethylpiperazino)nicotinic acid Formula: C20H26N4O6S MolecularWeight: 450.50864

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Descriptors Computed from Structure

Canonical SMILES:

CCN1CCN(CC1)C2=C(C=C(C=N2)C(=O)O)NS(=O)(=O)C3=CC(=C(C=C3)OC)OC

Isomeric SMILES

CCN1CCN(CC1)C2=C(C=C(C=N2)C(=O)O)NS(=O)(=O)C3=CC(=C(C=C3)OC)OC

InChI

InChI=1S/C20H26N4O6S/c1-4-23-7-9-24(10-8-23)19-16(11-14(13-21-19)20(25)26)22-31(27,28)15-5-6-17(29-2)18(12-15)30-3/h5-6,11-13,22H,4,7-10H2,1-3H3,(H,25,26)