N6-(3-fluoranyl-4-methoxy-phenyl)-N2-methyl-N2-(1-methylpiperidin-4-yl)-N4-propyl-1,3,5-triazine-2,4,6-triamine

Systemtic Name: N6-(3-fluoranyl-4-methoxy-phenyl)-N2-methyl-N2-(1-methylpiperidin-4-yl)-N4-propyl-1,3,5-triazine-2,4,6-triamine Openeye Name: N6-(3-fluoro-4-methoxy-phenyl)-N2-methyl-N2-(1-methyl-4-piperidyl)-N4-propyl-1,3,5-triazine-2,4,6-triamine CAS Name: N6-(3-fluoro-4-methoxyphenyl)-N2-methyl-N2-(1-methyl-4-piperidinyl)-N4-propyl-1,3,5-triazine-2,4,6-triamine IUPAC Name: 6-N-(3-fluoro-4-methoxyphenyl)-2-N-methyl-2-N-(1-methylpiperidin-4-yl)-4-N-propyl-1,3,5-triazine-2,4,6-triamine Traditional Name: [4-(3-fluoro-4-methoxy-anilino)-6-(propylamino)-s-triazin-2-yl]-methyl-(1-methyl-4-piperidyl)amine Formula: C20H30FN7O MolecularWeight: 403.496903

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Descriptors Computed from Structure

Canonical SMILES:

CCCNC1=NC(=NC(=N1)NC2=CC(=C(C=C2)OC)F)N(C)C3CCN(CC3)C

Isomeric SMILES

CCCNC1=NC(=NC(=N1)NC2=CC(=C(C=C2)OC)F)N(C)C3CCN(CC3)C

InChI

InChI=1S/C20H30FN7O/c1-5-10-22-18-24-19(23-14-6-7-17(29-4)16(21)13-14)26-20(25-18)28(3)15-8-11-27(2)12-9-15/h6-7,13,15H,5,8-12H2,1-4H3,(H2,22,23,24,25,26)