5-(ethylsulfonylamino)-2-[methyl-(phenylmethyl)amino]pyridine-3-carboxylic acid

Systemtic Name: 5-(ethylsulfonylamino)-2-[methyl-(phenylmethyl)amino]pyridine-3-carboxylic acid Openeye Name: 2-[benzyl(methyl)amino]-5-(ethylsulfonylamino)pyridine-3-carboxylic acid CAS Name: 5-(ethylsulfonylamino)-2-[methyl-(phenylmethyl)amino]-3-pyridinecarboxylic acid IUPAC Name: 2-[benzyl(methyl)amino]-5-(ethylsulfonylamino)pyridine-3-carboxylic acid Traditional Name: 2-[benzyl(methyl)amino]-5-(esylamino)nicotinic acid Formula: C16H19N3O4S MolecularWeight: 349.40476

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Descriptors Computed from Structure

Canonical SMILES:

CCS(=O)(=O)NC1=CN=C(C(=C1)C(=O)O)N(C)CC2=CC=CC=C2

Isomeric SMILES

CCS(=O)(=O)NC1=CN=C(C(=C1)C(=O)O)N(C)CC2=CC=CC=C2

InChI

InChI=1S/C16H19N3O4S/c1-3-24(22,23)18-13-9-14(16(20)21)15(17-10-13)19(2)11-12-7-5-4-6-8-12/h4-10,18H,3,11H2,1-2H3,(H,20,21)