N6-[2-azanyl-6-(2-methoxyphenyl)pyrimidin-4-yl]-2-pentyl-quinoline-4,6-diamine

Systemtic Name: N6-[2-azanyl-6-(2-methoxyphenyl)pyrimidin-4-yl]-2-pentyl-quinoline-4,6-diamine Openeye Name: N6-[2-amino-6-(2-methoxyphenyl)pyrimidin-4-yl]-2-pentyl-quinoline-4,6-diamine CAS Name: N6-[2-amino-6-(2-methoxyphenyl)-4-pyrimidinyl]-2-pentylquinoline-4,6-diamine IUPAC Name: 6-N-[2-amino-6-(2-methoxyphenyl)pyrimidin-4-yl]-2-pentylquinoline-4,6-diamine Traditional Name: (4-amino-2-amyl-6-quinolyl)-[2-amino-6-(2-methoxyphenyl)pyrimidin-4-yl]amine Formula: C25H28N6O MolecularWeight: 428.52942

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCC1=NC2=C(C=C(C=C2)NC3=NC(=NC(=C3)C4=CC=CC=C4OC)N)C(=C1)N

Isomeric SMILES

CCCCCC1=NC2=C(C=C(C=C2)NC3=NC(=NC(=C3)C4=CC=CC=C4OC)N)C(=C1)N

InChI

InChI=1S/C25H28N6O/c1-3-4-5-8-16-14-20(26)19-13-17(11-12-21(19)28-16)29-24-15-22(30-25(27)31-24)18-9-6-7-10-23(18)32-2/h6-7,9-15H,3-5,8H2,1-2H3,(H2,26,28)(H3,27,29,30,31)