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

Systemtic Name: N-[2-(4-fluorophenyl)ethyl]-4-[[(4-methylphenyl)sulfonyl-pyrimidin-2-yl-amino]methyl]benzamide Openeye Name: N-[2-(4-fluorophenyl)ethyl]-4-[[p-tolylsulfonyl(pyrimidin-2-yl)amino]methyl]benzamide CAS Name: N-[2-(4-fluorophenyl)ethyl]-4-[[(4-methylphenyl)sulfonyl-(2-pyrimidinyl)amino]methyl]benzamide IUPAC Name: N-[2-(4-fluorophenyl)ethyl]-4-[[(4-methylphenyl)sulfonyl-pyrimidin-2-ylamino]methyl]benzamide Traditional Name: N-[2-(4-fluorophenyl)ethyl]-4-[[2-pyrimidyl(tosyl)amino]methyl]benzamide Formula: C27H25FN4O3S MolecularWeight: 504.575803

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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)F)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)F)C4=NC=CC=N4

InChI

InChI=1S/C27H25FN4O3S/c1-20-3-13-25(14-4-20)36(34,35)32(27-30-16-2-17-31-27)19-22-5-9-23(10-6-22)26(33)29-18-15-21-7-11-24(28)12-8-21/h2-14,16-17H,15,18-19H2,1H3,(H,29,33)