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

Systemtic Name: N-[2-(4-hydroxyphenyl)ethyl]-4-[[(4-methylphenyl)sulfonyl-pyrimidin-2-yl-amino]methyl]benzamide Openeye Name: N-[2-(4-hydroxyphenyl)ethyl]-4-[[p-tolylsulfonyl(pyrimidin-2-yl)amino]methyl]benzamide CAS Name: N-[2-(4-hydroxyphenyl)ethyl]-4-[[(4-methylphenyl)sulfonyl-(2-pyrimidinyl)amino]methyl]benzamide IUPAC Name: N-[2-(4-hydroxyphenyl)ethyl]-4-[[(4-methylphenyl)sulfonyl-pyrimidin-2-ylamino]methyl]benzamide Traditional Name: N-[2-(4-hydroxyphenyl)ethyl]-4-[[2-pyrimidyl(tosyl)amino]methyl]benzamide Formula: C27H26N4O4S MolecularWeight: 502.58474

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)N(CC2=CC=C(C=C2)C(=O)NCCC3=CC=C(C=C3)O)C4=NC=CC=N4

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)N(CC2=CC=C(C=C2)C(=O)NCCC3=CC=C(C=C3)O)C4=NC=CC=N4

InChI

InChI=1S/C27H26N4O4S/c1-20-3-13-25(14-4-20)36(34,35)31(27-29-16-2-17-30-27)19-22-5-9-23(10-6-22)26(33)28-18-15-21-7-11-24(32)12-8-21/h2-14,16-17,32H,15,18-19H2,1H3,(H,28,33)