5-[(4,8-dimethoxy-2-pentyl-quinolin-6-yl)methyl]pyrimidine-2,4-diamine

Systemtic Name: 5-[(4,8-dimethoxy-2-pentyl-quinolin-6-yl)methyl]pyrimidine-2,4-diamine Openeye Name: 5-[(4,8-dimethoxy-2-pentyl-6-quinolyl)methyl]pyrimidine-2,4-diamine CAS Name: 5-[(4,8-dimethoxy-2-pentyl-6-quinolinyl)methyl]pyrimidine-2,4-diamine IUPAC Name: 5-[(4,8-dimethoxy-2-pentylquinolin-6-yl)methyl]pyrimidine-2,4-diamine Traditional Name: [2-amino-5-[(2-amyl-4,8-dimethoxy-6-quinolyl)methyl]pyrimidin-4-yl]amine Formula: C21H27N5O2 MolecularWeight: 381.47138

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCC1=NC2=C(C=C(C=C2C(=C1)OC)CC3=CN=C(N=C3N)N)OC

Isomeric SMILES

CCCCCC1=NC2=C(C=C(C=C2C(=C1)OC)CC3=CN=C(N=C3N)N)OC

InChI

InChI=1S/C21H27N5O2/c1-4-5-6-7-15-11-17(27-2)16-9-13(10-18(28-3)19(16)25-15)8-14-12-24-21(23)26-20(14)22/h9-12H,4-8H2,1-3H3,(H4,22,23,24,26)