N-[4-[[6-(3-aminophenyl)pyrimidin-4-yl]amino]phenyl]-4-methyl-benzenesulfonamide

Systemtic Name: N-[4-[[6-(3-aminophenyl)pyrimidin-4-yl]amino]phenyl]-4-methyl-benzenesulfonamide Openeye Name: N-[4-[[6-(3-aminophenyl)pyrimidin-4-yl]amino]phenyl]-4-methyl-benzenesulfonamide CAS Name: N-[4-[[6-(3-aminophenyl)-4-pyrimidinyl]amino]phenyl]-4-methylbenzenesulfonamide IUPAC Name: N-[4-[[6-(3-aminophenyl)pyrimidin-4-yl]amino]phenyl]-4-methylbenzenesulfonamide Traditional Name: N-[4-[[6-(3-aminophenyl)pyrimidin-4-yl]amino]phenyl]-4-methyl-benzenesulfonamide Formula: C23H21N5O2S MolecularWeight: 431.51014

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)NC2=CC=C(C=C2)NC3=NC=NC(=C3)C4=CC(=CC=C4)N

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)NC2=CC=C(C=C2)NC3=NC=NC(=C3)C4=CC(=CC=C4)N

InChI

InChI=1S/C23H21N5O2S/c1-16-5-11-21(12-6-16)31(29,30)28-20-9-7-19(8-10-20)27-23-14-22(25-15-26-23)17-3-2-4-18(24)13-17/h2-15,28H,24H2,1H3,(H,25,26,27)