N,3-bis[2-[[cyclohexyl(methyl)amino]methyl]phenyl]-[1,2,3]triazolo[4,5-d]pyrimidin-5-amine

Systemtic Name: N,3-bis[2-[[cyclohexyl(methyl)amino]methyl]phenyl]-[1,2,3]triazolo[4,5-d]pyrimidin-5-amine Openeye Name: N,3-bis[2-[[cyclohexyl(methyl)amino]methyl]phenyl]triazolo[4,5-d]pyrimidin-5-amine CAS Name: N,3-bis[2-[[cyclohexyl(methyl)amino]methyl]phenyl]-5-triazolo[4,5-d]pyrimidinamine IUPAC Name: N,3-bis[2-[[cyclohexyl(methyl)amino]methyl]phenyl]triazolo[4,5-d]pyrimidin-5-amine Traditional Name: cyclohexyl-[2-[5-[2-[[cyclohexyl(methyl)amino]methyl]anilino]triazolo[4,5-d]pyrimidin-3-yl]benzyl]-methyl-amine Formula: C32H42N8 MolecularWeight: 538.72948

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Descriptors Computed from Structure

Canonical SMILES:

CN(CC1=CC=CC=C1NC2=NC=C3C(=N2)N(N=N3)C4=CC=CC=C4CN(C)C5CCCCC5)C6CCCCC6

Isomeric SMILES

CN(CC1=CC=CC=C1NC2=NC=C3C(=N2)N(N=N3)C4=CC=CC=C4CN(C)C5CCCCC5)C6CCCCC6

InChI

InChI=1S/C32H42N8/c1-38(26-15-5-3-6-16-26)22-24-13-9-11-19-28(24)34-32-33-21-29-31(35-32)40(37-36-29)30-20-12-10-14-25(30)23-39(2)27-17-7-4-8-18-27/h9-14,19-21,26-27H,3-8,15-18,22-23H2,1-2H3,(H,33,34,35)