(phenylmethyl) 2-[[(4-benzamidophenyl)sulfonylamino]-pyridin-3-yl-amino]propanoate

Systemtic Name: (phenylmethyl) 2-[[(4-benzamidophenyl)sulfonylamino]-pyridin-3-yl-amino]propanoate Openeye Name: benzyl 2-[[(4-benzamidophenyl)sulfonylamino]-(3-pyridyl)amino]propanoate CAS Name: 2-[[(4-benzamidophenyl)sulfonylamino]-(3-pyridinyl)amino]propanoic acid (phenylmethyl) ester IUPAC Name: benzyl 2-[[(4-benzamidophenyl)sulfonylamino]-pyridin-3-ylamino]propanoate Traditional Name: 2-[[(4-benzamidophenyl)sulfonylamino]-(3-pyridyl)amino]propionic acid benzyl ester Formula: C28H26N4O5S MolecularWeight: 530.59484

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)OCC1=CC=CC=C1)N(C2=CN=CC=C2)NS(=O)(=O)C3=CC=C(C=C3)NC(=O)C4=CC=CC=C4

Isomeric SMILES

CC(C(=O)OCC1=CC=CC=C1)N(C2=CN=CC=C2)NS(=O)(=O)C3=CC=C(C=C3)NC(=O)C4=CC=CC=C4

InChI

InChI=1S/C28H26N4O5S/c1-21(28(34)37-20-22-9-4-2-5-10-22)32(25-13-8-18-29-19-25)31-38(35,36)26-16-14-24(15-17-26)30-27(33)23-11-6-3-7-12-23/h2-19,21,31H,20H2,1H3,(H,30,33)