5-[4-[(4-methylsulfonylphenyl)methoxy]phenyl]-6-(phenylmethoxymethyl)pyrimidine-2,4-diamine

Systemtic Name: 5-[4-[(4-methylsulfonylphenyl)methoxy]phenyl]-6-(phenylmethoxymethyl)pyrimidine-2,4-diamine Openeye Name: 6-(benzyloxymethyl)-5-[4-[(4-methylsulfonylphenyl)methoxy]phenyl]pyrimidine-2,4-diamine CAS Name: 5-[4-[(4-methylsulfonylphenyl)methoxy]phenyl]-6-(phenylmethoxymethyl)pyrimidine-2,4-diamine IUPAC Name: 5-[4-[(4-methylsulfonylphenyl)methoxy]phenyl]-6-(phenylmethoxymethyl)pyrimidine-2,4-diamine Traditional Name: [2-amino-6-(benzoxymethyl)-5-[4-(4-mesylbenzyl)oxyphenyl]pyrimidin-4-yl]amine Formula: C26H26N4O4S MolecularWeight: 490.57404

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Descriptors Computed from Structure

Canonical SMILES:

CS(=O)(=O)C1=CC=C(C=C1)COC2=CC=C(C=C2)C3=C(N=C(N=C3N)N)COCC4=CC=CC=C4

Isomeric SMILES

CS(=O)(=O)C1=CC=C(C=C1)COC2=CC=C(C=C2)C3=C(N=C(N=C3N)N)COCC4=CC=CC=C4

InChI

InChI=1S/C26H26N4O4S/c1-35(31,32)22-13-7-19(8-14-22)16-34-21-11-9-20(10-12-21)24-23(29-26(28)30-25(24)27)17-33-15-18-5-3-2-4-6-18/h2-14H,15-17H2,1H3,(H4,27,28,29,30)