ethyl 4-[(4-ethylphenyl)methyl-(pyridin-3-ylmethyl)sulfamoyl]benzoate

Systemtic Name: ethyl 4-[(4-ethylphenyl)methyl-(pyridin-3-ylmethyl)sulfamoyl]benzoate Openeye Name: ethyl 4-[(4-ethylphenyl)methyl-(3-pyridylmethyl)sulfamoyl]benzoate CAS Name: 4-[(4-ethylphenyl)methyl-(3-pyridinylmethyl)sulfamoyl]benzoic acid ethyl ester IUPAC Name: ethyl 4-[(4-ethylphenyl)methyl-(pyridin-3-ylmethyl)sulfamoyl]benzoate Traditional Name: 4-[(4-ethylbenzyl)-(3-pyridylmethyl)sulfamoyl]benzoic acid ethyl ester Formula: C24H26N2O4S MolecularWeight: 438.53924

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC=C(C=C1)CN(CC2=CN=CC=C2)S(=O)(=O)C3=CC=C(C=C3)C(=O)OCC

Isomeric SMILES

CCC1=CC=C(C=C1)CN(CC2=CN=CC=C2)S(=O)(=O)C3=CC=C(C=C3)C(=O)OCC

InChI

InChI=1S/C24H26N2O4S/c1-3-19-7-9-20(10-8-19)17-26(18-21-6-5-15-25-16-21)31(28,29)23-13-11-22(12-14-23)24(27)30-4-2/h5-16H,3-4,17-18H2,1-2H3