1-[[4,8-bis[methyl-(phenylmethyl)amino]-2-(2-oxidanylpropylamino)pyrimido[5,4-d]pyrimidin-6-yl]amino]propan-2-ol

Systemtic Name: 1-[[4,8-bis[methyl-(phenylmethyl)amino]-2-(2-oxidanylpropylamino)pyrimido[5,4-d]pyrimidin-6-yl]amino]propan-2-ol Openeye Name: 1-[[4,8-bis[benzyl(methyl)amino]-2-(2-hydroxypropylamino)pyrimido[5,4-d]pyrimidin-6-yl]amino]propan-2-ol CAS Name: 1-[[2-(2-hydroxypropylamino)-4,8-bis[methyl-(phenylmethyl)amino]-6-pyrimido[5,4-d]pyrimidinyl]amino]-2-propanol IUPAC Name: 1-[[4,8-bis[benzyl(methyl)amino]-2-(2-hydroxypropylamino)pyrimido[5,4-d]pyrimidin-6-yl]amino]propan-2-ol Traditional Name: 1-[[4,8-bis[benzyl(methyl)amino]-2-(2-hydroxypropylamino)pyrimido[5,4-d]pyrimidin-6-yl]amino]propan-2-ol Formula: C28H36N8O2 MolecularWeight: 516.63784

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Descriptors Computed from Structure

Canonical SMILES:

CC(CNC1=NC2=C(C(=N1)N(C)CC3=CC=CC=C3)N=C(N=C2N(C)CC4=CC=CC=C4)NCC(C)O)O

Isomeric SMILES

CC(CNC1=NC2=C(C(=N1)N(C)CC3=CC=CC=C3)N=C(N=C2N(C)CC4=CC=CC=C4)NCC(C)O)O

InChI

InChI=1S/C28H36N8O2/c1-19(37)15-29-27-31-23-24(25(33-27)35(3)17-21-11-7-5-8-12-21)32-28(30-16-20(2)38)34-26(23)36(4)18-22-13-9-6-10-14-22/h5-14,19-20,37-38H,15-18H2,1-4H3,(H,29,31,33)(H,30,32,34)