N2,N4,N7-tris[(2,4-dimethylphenyl)methyl]-6-methylsulfonyl-pteridine-2,4,7-triamine

Systemtic Name: N2,N4,N7-tris[(2,4-dimethylphenyl)methyl]-6-methylsulfonyl-pteridine-2,4,7-triamine Openeye Name: N2,N4,N7-tris[(2,4-dimethylphenyl)methyl]-6-methylsulfonyl-pteridine-2,4,7-triamine CAS Name: N2,N4,N7-tris[(2,4-dimethylphenyl)methyl]-6-methylsulfonylpteridine-2,4,7-triamine IUPAC Name: 2-N,4-N,7-N-tris[(2,4-dimethylphenyl)methyl]-6-methylsulfonylpteridine-2,4,7-triamine Traditional Name: [2,4-bis[(2,4-dimethylbenzyl)amino]-6-mesyl-pteridin-7-yl]-(2,4-dimethylbenzyl)amine Formula: C34H39N7O2S MolecularWeight: 609.78416

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)CNC2=NC(=NC3=C2N=C(C(=N3)NCC4=C(C=C(C=C4)C)C)S(=O)(=O)C)NCC5=C(C=C(C=C5)C)C)C

Isomeric SMILES

CC1=CC(=C(C=C1)CNC2=NC(=NC3=C2N=C(C(=N3)NCC4=C(C=C(C=C4)C)C)S(=O)(=O)C)NCC5=C(C=C(C=C5)C)C)C

InChI

InChI=1S/C34H39N7O2S/c1-20-8-11-26(23(4)14-20)17-35-30-29-31(41-34(40-30)37-19-28-13-10-22(3)16-25(28)6)39-32(33(38-29)44(7,42)43)36-18-27-12-9-21(2)15-24(27)5/h8-16H,17-19H2,1-7H3,(H3,35,36,37,39,40,41)