N-ethyl-4-[[(4-methylphenyl)sulfonyl-pyrimidin-2-yl-amino]methyl]benzamide

Systemtic Name: N-ethyl-4-[[(4-methylphenyl)sulfonyl-pyrimidin-2-yl-amino]methyl]benzamide Openeye Name: N-ethyl-4-[[p-tolylsulfonyl(pyrimidin-2-yl)amino]methyl]benzamide CAS Name: N-ethyl-4-[[(4-methylphenyl)sulfonyl-(2-pyrimidinyl)amino]methyl]benzamide IUPAC Name: N-ethyl-4-[[(4-methylphenyl)sulfonyl-pyrimidin-2-ylamino]methyl]benzamide Traditional Name: N-ethyl-4-[[2-pyrimidyl(tosyl)amino]methyl]benzamide Formula: C21H22N4O3S MolecularWeight: 410.48938

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Descriptors Computed from Structure

Canonical SMILES:

CCNC(=O)C1=CC=C(C=C1)CN(C2=NC=CC=N2)S(=O)(=O)C3=CC=C(C=C3)C

Isomeric SMILES

CCNC(=O)C1=CC=C(C=C1)CN(C2=NC=CC=N2)S(=O)(=O)C3=CC=C(C=C3)C

InChI

InChI=1S/C21H22N4O3S/c1-3-22-20(26)18-9-7-17(8-10-18)15-25(21-23-13-4-14-24-21)29(27,28)19-11-5-16(2)6-12-19/h4-14H,3,15H2,1-2H3,(H,22,26)