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

Systemtic Name: N6-[2-azanyl-6-(phenoxymethyl)pyrimidin-4-yl]-2-methyl-quinoline-4,6-diamine Openeye Name: N6-[2-amino-6-(phenoxymethyl)pyrimidin-4-yl]-2-methyl-quinoline-4,6-diamine CAS Name: N6-[2-amino-6-(phenoxymethyl)-4-pyrimidinyl]-2-methylquinoline-4,6-diamine IUPAC Name: 6-N-[2-amino-6-(phenoxymethyl)pyrimidin-4-yl]-2-methylquinoline-4,6-diamine Traditional Name: (4-amino-2-methyl-6-quinolyl)-[2-amino-6-(phenoxymethyl)pyrimidin-4-yl]amine Formula: C21H20N6O MolecularWeight: 372.4231

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC2=C(C=C(C=C2)NC3=NC(=NC(=C3)COC4=CC=CC=C4)N)C(=C1)N

Isomeric SMILES

CC1=NC2=C(C=C(C=C2)NC3=NC(=NC(=C3)COC4=CC=CC=C4)N)C(=C1)N

InChI

InChI=1S/C21H20N6O/c1-13-9-18(22)17-10-14(7-8-19(17)24-13)25-20-11-15(26-21(23)27-20)12-28-16-5-3-2-4-6-16/h2-11H,12H2,1H3,(H2,22,24)(H3,23,25,26,27)