N4-hexyl-N2-(4-iodanyl-2-methyl-phenyl)-6-morpholin-4-yl-1,3,5-triazine-2,4-diamine

Systemtic Name: N4-hexyl-N2-(4-iodanyl-2-methyl-phenyl)-6-morpholin-4-yl-1,3,5-triazine-2,4-diamine Openeye Name: N4-hexyl-N2-(4-iodo-2-methyl-phenyl)-6-morpholino-1,3,5-triazine-2,4-diamine CAS Name: N4-hexyl-N2-(4-iodo-2-methylphenyl)-6-(4-morpholinyl)-1,3,5-triazine-2,4-diamine IUPAC Name: 4-N-hexyl-2-N-(4-iodo-2-methylphenyl)-6-morpholin-4-yl-1,3,5-triazine-2,4-diamine Traditional Name: hexyl-[4-(4-iodo-2-methyl-anilino)-6-morpholino-s-triazin-2-yl]amine Formula: C20H29IN6O MolecularWeight: 496.38833

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCNC1=NC(=NC(=N1)NC2=C(C=C(C=C2)I)C)N3CCOCC3

Isomeric SMILES

CCCCCCNC1=NC(=NC(=N1)NC2=C(C=C(C=C2)I)C)N3CCOCC3

InChI

InChI=1S/C20H29IN6O/c1-3-4-5-6-9-22-18-24-19(23-17-8-7-16(21)14-15(17)2)26-20(25-18)27-10-12-28-13-11-27/h7-8,14H,3-6,9-13H2,1-2H3,(H2,22,23,24,25,26)