N6-[2-azanyl-6-(3-phenylmethoxyphenyl)pyrimidin-4-yl]-2-(4-cyclohexylphenyl)quinoline-4,6-diamine

Systemtic Name: N6-[2-azanyl-6-(3-phenylmethoxyphenyl)pyrimidin-4-yl]-2-(4-cyclohexylphenyl)quinoline-4,6-diamine Openeye Name: N6-[2-amino-6-(3-benzyloxyphenyl)pyrimidin-4-yl]-2-(4-cyclohexylphenyl)quinoline-4,6-diamine CAS Name: N6-[2-amino-6-(3-phenylmethoxyphenyl)-4-pyrimidinyl]-2-(4-cyclohexylphenyl)quinoline-4,6-diamine IUPAC Name: 6-N-[2-amino-6-(3-phenylmethoxyphenyl)pyrimidin-4-yl]-2-(4-cyclohexylphenyl)quinoline-4,6-diamine Traditional Name: [2-amino-6-(3-benzoxyphenyl)pyrimidin-4-yl]-[4-amino-2-(4-cyclohexylphenyl)-6-quinolyl]amine Formula: C38H36N6O MolecularWeight: 592.73204

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(CC1)C2=CC=C(C=C2)C3=NC4=C(C=C(C=C4)NC5=NC(=NC(=C5)C6=CC(=CC=C6)OCC7=CC=CC=C7)N)C(=C3)N

Isomeric SMILES

C1CCC(CC1)C2=CC=C(C=C2)C3=NC4=C(C=C(C=C4)NC5=NC(=NC(=C5)C6=CC(=CC=C6)OCC7=CC=CC=C7)N)C(=C3)N

InChI

InChI=1S/C38H36N6O/c39-33-22-35(28-16-14-27(15-17-28)26-10-5-2-6-11-26)42-34-19-18-30(21-32(33)34)41-37-23-36(43-38(40)44-37)29-12-7-13-31(20-29)45-24-25-8-3-1-4-9-25/h1,3-4,7-9,12-23,26H,2,5-6,10-11,24H2,(H2,39,42)(H3,40,41,43,44)