N2-[4-[(5-bromanyl-1H-indol-3-yl)methylamino]cyclohexyl]-N4,N4-dimethyl-pyrimidine-2,4-diamine

Systemtic Name: N2-[4-[(5-bromanyl-1H-indol-3-yl)methylamino]cyclohexyl]-N4,N4-dimethyl-pyrimidine-2,4-diamine Openeye Name: N2-[4-[(5-bromo-1H-indol-3-yl)methylamino]cyclohexyl]-N4,N4-dimethyl-pyrimidine-2,4-diamine CAS Name: N2-[4-[(5-bromo-1H-indol-3-yl)methylamino]cyclohexyl]-N4,N4-dimethylpyrimidine-2,4-diamine IUPAC Name: 2-N-[4-[(5-bromo-1H-indol-3-yl)methylamino]cyclohexyl]-4-N,4-N-dimethylpyrimidine-2,4-diamine Traditional Name: [2-[[4-[(5-bromo-1H-indol-3-yl)methylamino]cyclohexyl]amino]pyrimidin-4-yl]-dimethyl-amine Formula: C21H27BrN6 MolecularWeight: 443.38328

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Descriptors Computed from Structure

Canonical SMILES:

CN(C)C1=NC(=NC=C1)NC2CCC(CC2)NCC3=CNC4=C3C=C(C=C4)Br

Isomeric SMILES

CN(C)C1=NC(=NC=C1)NC2CCC(CC2)NCC3=CNC4=C3C=C(C=C4)Br

InChI

InChI=1S/C21H27BrN6/c1-28(2)20-9-10-23-21(27-20)26-17-6-4-16(5-7-17)24-12-14-13-25-19-8-3-15(22)11-18(14)19/h3,8-11,13,16-17,24-25H,4-7,12H2,1-2H3,(H,23,26,27)