2,6-bis(chloranyl)-N4,N8-dioctadecyl-pyrimido[5,4-d]pyrimidine-4,8-diamine

Systemtic Name: 2,6-bis(chloranyl)-N4,N8-dioctadecyl-pyrimido[5,4-d]pyrimidine-4,8-diamine Openeye Name: 2,6-dichloro-N4,N8-dioctadecyl-pyrimido[5,4-d]pyrimidine-4,8-diamine CAS Name: 2,6-dichloro-N4,N8-dioctadecylpyrimido[5,4-d]pyrimidine-4,8-diamine IUPAC Name: 2,6-dichloro-4-N,8-N-dioctadecylpyrimido[5,4-d]pyrimidine-4,8-diamine Traditional Name: [2,6-dichloro-4-(stearylamino)pyrimido[5,4-d]pyrimidin-8-yl]-stearyl-amine Formula: C42H76Cl2N6 MolecularWeight: 735.99904

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCCCCCNC1=NC(=NC2=C1N=C(N=C2NCCCCCCCCCCCCCCCCCC)Cl)Cl

Isomeric SMILES

CCCCCCCCCCCCCCCCCCNC1=NC(=NC2=C1N=C(N=C2NCCCCCCCCCCCCCCCCCC)Cl)Cl

InChI

InChI=1S/C42H76Cl2N6/c1-3-5-7-9-11-13-15-17-19-21-23-25-27-29-31-33-35-45-39-37-38(48-41(43)49-39)40(50-42(44)47-37)46-36-34-32-30-28-26-24-22-20-18-16-14-12-10-8-6-4-2/h3-36H2,1-2H3,(H,45,48,49)(H,46,47,50)