ethyl 4-[[(4-methylphenyl)sulfonyl-(pyridin-4-ylmethyl)amino]methyl]benzoate

Systemtic Name: ethyl 4-[[(4-methylphenyl)sulfonyl-(pyridin-4-ylmethyl)amino]methyl]benzoate Openeye Name: ethyl 4-[[p-tolylsulfonyl(4-pyridylmethyl)amino]methyl]benzoate CAS Name: 4-[[(4-methylphenyl)sulfonyl-(pyridin-4-ylmethyl)amino]methyl]benzoic acid ethyl ester IUPAC Name: ethyl 4-[[(4-methylphenyl)sulfonyl-(pyridin-4-ylmethyl)amino]methyl]benzoate Traditional Name: 4-[[4-pyridylmethyl(tosyl)amino]methyl]benzoic acid ethyl ester Formula: C23H24N2O4S MolecularWeight: 424.51266

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=CC=C(C=C1)CN(CC2=CC=NC=C2)S(=O)(=O)C3=CC=C(C=C3)C

Isomeric SMILES

CCOC(=O)C1=CC=C(C=C1)CN(CC2=CC=NC=C2)S(=O)(=O)C3=CC=C(C=C3)C

InChI

InChI=1S/C23H24N2O4S/c1-3-29-23(26)21-8-6-19(7-9-21)16-25(17-20-12-14-24-15-13-20)30(27,28)22-10-4-18(2)5-11-22/h4-15H,3,16-17H2,1-2H3