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

Systemtic Name: 4-[[(4-methylphenyl)sulfonyl-pyrimidin-2-yl-amino]methyl]-N-phenyl-benzamide Openeye Name: N-phenyl-4-[[p-tolylsulfonyl(pyrimidin-2-yl)amino]methyl]benzamide CAS Name: 4-[[(4-methylphenyl)sulfonyl-(2-pyrimidinyl)amino]methyl]-N-phenylbenzamide IUPAC Name: 4-[[(4-methylphenyl)sulfonyl-pyrimidin-2-ylamino]methyl]-N-phenylbenzamide Traditional Name: N-phenyl-4-[[2-pyrimidyl(tosyl)amino]methyl]benzamide Formula: C25H22N4O3S MolecularWeight: 458.53218

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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)NC3=CC=CC=C3)C4=NC=CC=N4

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)N(CC2=CC=C(C=C2)C(=O)NC3=CC=CC=C3)C4=NC=CC=N4

InChI

InChI=1S/C25H22N4O3S/c1-19-8-14-23(15-9-19)33(31,32)29(25-26-16-5-17-27-25)18-20-10-12-21(13-11-20)24(30)28-22-6-3-2-4-7-22/h2-17H,18H2,1H3,(H,28,30)