6-ethyl-N4,N4-dimethyl-5-[4-[(4-methylsulfonylphenyl)methylamino]phenyl]pyrimidine-2,4-diamine

Systemtic Name: 6-ethyl-N4,N4-dimethyl-5-[4-[(4-methylsulfonylphenyl)methylamino]phenyl]pyrimidine-2,4-diamine Openeye Name: 6-ethyl-N4,N4-dimethyl-5-[4-[(4-methylsulfonylphenyl)methylamino]phenyl]pyrimidine-2,4-diamine CAS Name: 6-ethyl-N4,N4-dimethyl-5-[4-[(4-methylsulfonylphenyl)methylamino]phenyl]pyrimidine-2,4-diamine IUPAC Name: 6-ethyl-4-N,4-N-dimethyl-5-[4-[(4-methylsulfonylphenyl)methylamino]phenyl]pyrimidine-2,4-diamine Traditional Name: [2-amino-6-ethyl-5-[4-[(4-mesylbenzyl)amino]phenyl]pyrimidin-4-yl]-dimethyl-amine Formula: C22H27N5O2S MolecularWeight: 425.54708

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=C(C(=NC(=N1)N)N(C)C)C2=CC=C(C=C2)NCC3=CC=C(C=C3)S(=O)(=O)C

Isomeric SMILES

CCC1=C(C(=NC(=N1)N)N(C)C)C2=CC=C(C=C2)NCC3=CC=C(C=C3)S(=O)(=O)C

InChI

InChI=1S/C22H27N5O2S/c1-5-19-20(21(27(2)3)26-22(23)25-19)16-8-10-17(11-9-16)24-14-15-6-12-18(13-7-15)30(4,28)29/h6-13,24H,5,14H2,1-4H3,(H2,23,25,26)