methyl 4-[2-[(4-chlorophenyl)sulfonylamino]-2-pyridin-3-yl-ethyl]benzoate

Systemtic Name: methyl 4-[2-[(4-chlorophenyl)sulfonylamino]-2-pyridin-3-yl-ethyl]benzoate Openeye Name: methyl 4-[2-[(4-chlorophenyl)sulfonylamino]-2-(3-pyridyl)ethyl]benzoate CAS Name: 4-[2-[(4-chlorophenyl)sulfonylamino]-2-(3-pyridinyl)ethyl]benzoic acid methyl ester IUPAC Name: methyl 4-[2-[(4-chlorophenyl)sulfonylamino]-2-pyridin-3-ylethyl]benzoate Traditional Name: 4-[2-[(4-chlorophenyl)sulfonylamino]-2-(3-pyridyl)ethyl]benzoic acid methyl ester Formula: C21H19ClN2O4S MolecularWeight: 430.90456

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=CC=C(C=C1)CC(C2=CN=CC=C2)NS(=O)(=O)C3=CC=C(C=C3)Cl

Isomeric SMILES

COC(=O)C1=CC=C(C=C1)CC(C2=CN=CC=C2)NS(=O)(=O)C3=CC=C(C=C3)Cl

InChI

InChI=1S/C21H19ClN2O4S/c1-28-21(25)16-6-4-15(5-7-16)13-20(17-3-2-12-23-14-17)24-29(26,27)19-10-8-18(22)9-11-19/h2-12,14,20,24H,13H2,1H3