2-[bis(phenylmethyl)amino]-5-(thiophen-2-ylsulfonylamino)pyridine-3-carboxylic acid

Systemtic Name: 2-[bis(phenylmethyl)amino]-5-(thiophen-2-ylsulfonylamino)pyridine-3-carboxylic acid Openeye Name: 2-(dibenzylamino)-5-(2-thienylsulfonylamino)pyridine-3-carboxylic acid CAS Name: 2-[bis(phenylmethyl)amino]-5-(thiophen-2-ylsulfonylamino)-3-pyridinecarboxylic acid IUPAC Name: 2-(dibenzylamino)-5-(thiophen-2-ylsulfonylamino)pyridine-3-carboxylic acid Traditional Name: 2-(dibenzylamino)-5-(2-thienylsulfonylamino)nicotinic acid Formula: C24H21N3O4S2 MolecularWeight: 479.57124

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CN(CC2=CC=CC=C2)C3=NC=C(C=C3C(=O)O)NS(=O)(=O)C4=CC=CS4

Isomeric SMILES

C1=CC=C(C=C1)CN(CC2=CC=CC=C2)C3=NC=C(C=C3C(=O)O)NS(=O)(=O)C4=CC=CS4

InChI

InChI=1S/C24H21N3O4S2/c28-24(29)21-14-20(26-33(30,31)22-12-7-13-32-22)15-25-23(21)27(16-18-8-3-1-4-9-18)17-19-10-5-2-6-11-19/h1-15,26H,16-17H2,(H,28,29)