4-azanyl-N-[[4-methyl-6-[(4-methylphenyl)amino]-2-phenyl-pyrimidin-5-yl]methyl]benzenesulfonamide

Systemtic Name: 4-azanyl-N-[[4-methyl-6-[(4-methylphenyl)amino]-2-phenyl-pyrimidin-5-yl]methyl]benzenesulfonamide Openeye Name: 4-amino-N-[[4-methyl-6-(4-methylanilino)-2-phenyl-pyrimidin-5-yl]methyl]benzenesulfonamide CAS Name: 4-amino-N-[[4-methyl-6-(4-methylanilino)-2-phenyl-5-pyrimidinyl]methyl]benzenesulfonamide IUPAC Name: 4-amino-N-[[4-methyl-6-(4-methylanilino)-2-phenylpyrimidin-5-yl]methyl]benzenesulfonamide Traditional Name: 4-amino-N-[[4-methyl-2-phenyl-6-(p-toluidino)pyrimidin-5-yl]methyl]benzenesulfonamide Formula: C25H25N5O2S MolecularWeight: 459.5633

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)NC2=NC(=NC(=C2CNS(=O)(=O)C3=CC=C(C=C3)N)C)C4=CC=CC=C4

Isomeric SMILES

CC1=CC=C(C=C1)NC2=NC(=NC(=C2CNS(=O)(=O)C3=CC=C(C=C3)N)C)C4=CC=CC=C4

InChI

InChI=1S/C25H25N5O2S/c1-17-8-12-21(13-9-17)29-25-23(16-27-33(31,32)22-14-10-20(26)11-15-22)18(2)28-24(30-25)19-6-4-3-5-7-19/h3-15,27H,16,26H2,1-2H3,(H,28,29,30)