2-chloranyl-N4,N5-didodecyl-N4,N5-diphenyl-pyrimidine-4,5-diamine

Systemtic Name: 2-chloranyl-N4,N5-didodecyl-N4,N5-diphenyl-pyrimidine-4,5-diamine Openeye Name: 2-chloro-N4,N5-didodecyl-N4,N5-diphenyl-pyrimidine-4,5-diamine CAS Name: 2-chloro-N4,N5-didodecyl-N4,N5-diphenylpyrimidine-4,5-diamine IUPAC Name: 2-chloro-4-N,5-N-didodecyl-4-N,5-N-diphenylpyrimidine-4,5-diamine Traditional Name: [2-chloro-4-(N-laurylanilino)pyrimidin-5-yl]-lauryl-phenyl-amine Formula: C40H61ClN4 MolecularWeight: 633.39214

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCN(C1=CC=CC=C1)C2=CN=C(N=C2N(CCCCCCCCCCCC)C3=CC=CC=C3)Cl

Isomeric SMILES

CCCCCCCCCCCCN(C1=CC=CC=C1)C2=CN=C(N=C2N(CCCCCCCCCCCC)C3=CC=CC=C3)Cl

InChI

InChI=1S/C40H61ClN4/c1-3-5-7-9-11-13-15-17-19-27-33-44(36-29-23-21-24-30-36)38-35-42-40(41)43-39(38)45(37-31-25-22-26-32-37)34-28-20-18-16-14-12-10-8-6-4-2/h21-26,29-32,35H,3-20,27-28,33-34H2,1-2H3