N4,N4-diethyl-6-[1-[2-(1-phenylethylamino)pyrimidin-4-yl]benzimidazol-5-yl]pyrimidine-2,4-diamine

Systemtic Name: N4,N4-diethyl-6-[1-[2-(1-phenylethylamino)pyrimidin-4-yl]benzimidazol-5-yl]pyrimidine-2,4-diamine Openeye Name: N4,N4-diethyl-6-[1-[2-(1-phenylethylamino)pyrimidin-4-yl]benzimidazol-5-yl]pyrimidine-2,4-diamine CAS Name: N4,N4-diethyl-6-[1-[2-(1-phenylethylamino)-4-pyrimidinyl]-5-benzimidazolyl]pyrimidine-2,4-diamine IUPAC Name: 4-N,4-N-diethyl-6-[1-[2-(1-phenylethylamino)pyrimidin-4-yl]benzimidazol-5-yl]pyrimidine-2,4-diamine Traditional Name: [2-amino-6-[1-[2-(1-phenylethylamino)pyrimidin-4-yl]benzimidazol-5-yl]pyrimidin-4-yl]-diethyl-amine Formula: C27H29N9 MolecularWeight: 479.57946

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)C1=NC(=NC(=C1)C2=CC3=C(C=C2)N(C=N3)C4=NC(=NC=C4)NC(C)C5=CC=CC=C5)N

Isomeric SMILES

CCN(CC)C1=NC(=NC(=C1)C2=CC3=C(C=C2)N(C=N3)C4=NC(=NC=C4)NC(C)C5=CC=CC=C5)N

InChI

InChI=1S/C27H29N9/c1-4-35(5-2)25-16-21(32-26(28)33-25)20-11-12-23-22(15-20)30-17-36(23)24-13-14-29-27(34-24)31-18(3)19-9-7-6-8-10-19/h6-18H,4-5H2,1-3H3,(H2,28,32,33)(H,29,31,34)