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

Systemtic Name: N6-[2-azanyl-6-(phenoxymethyl)pyrimidin-4-yl]-2-(3-chlorophenyl)quinoline-4,6-diamine Openeye Name: N6-[2-amino-6-(phenoxymethyl)pyrimidin-4-yl]-2-(3-chlorophenyl)quinoline-4,6-diamine CAS Name: N6-[2-amino-6-(phenoxymethyl)-4-pyrimidinyl]-2-(3-chlorophenyl)quinoline-4,6-diamine IUPAC Name: 6-N-[2-amino-6-(phenoxymethyl)pyrimidin-4-yl]-2-(3-chlorophenyl)quinoline-4,6-diamine Traditional Name: [4-amino-2-(3-chlorophenyl)-6-quinolyl]-[2-amino-6-(phenoxymethyl)pyrimidin-4-yl]amine Formula: C26H21ClN6O MolecularWeight: 468.93754

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)OCC2=CC(=NC(=N2)N)NC3=CC4=C(C=C3)N=C(C=C4N)C5=CC(=CC=C5)Cl

Isomeric SMILES

C1=CC=C(C=C1)OCC2=CC(=NC(=N2)N)NC3=CC4=C(C=C3)N=C(C=C4N)C5=CC(=CC=C5)Cl

InChI

InChI=1S/C26H21ClN6O/c27-17-6-4-5-16(11-17)24-14-22(28)21-12-18(9-10-23(21)32-24)30-25-13-19(31-26(29)33-25)15-34-20-7-2-1-3-8-20/h1-14H,15H2,(H2,28,32)(H3,29,30,31,33)