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

Systemtic Name: N2-(4-iodanyl-2-methyl-phenyl)-N4-(2-morpholin-4-ylethyl)-6-pyrrolidin-1-yl-1,3,5-triazine-2,4-diamine Openeye Name: N2-(4-iodo-2-methyl-phenyl)-N4-(2-morpholinoethyl)-6-pyrrolidin-1-yl-1,3,5-triazine-2,4-diamine CAS Name: N2-(4-iodo-2-methylphenyl)-N4-[2-(4-morpholinyl)ethyl]-6-(1-pyrrolidinyl)-1,3,5-triazine-2,4-diamine IUPAC Name: 2-N-(4-iodo-2-methylphenyl)-4-N-(2-morpholin-4-ylethyl)-6-pyrrolidin-1-yl-1,3,5-triazine-2,4-diamine Traditional Name: [4-(4-iodo-2-methyl-anilino)-6-pyrrolidino-s-triazin-2-yl]-(2-morpholinoethyl)amine Formula: C20H28IN7O MolecularWeight: 509.38709

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1)I)NC2=NC(=NC(=N2)N3CCCC3)NCCN4CCOCC4

Isomeric SMILES

CC1=C(C=CC(=C1)I)NC2=NC(=NC(=N2)N3CCCC3)NCCN4CCOCC4

InChI

InChI=1S/C20H28IN7O/c1-15-14-16(21)4-5-17(15)23-19-24-18(22-6-9-27-10-12-29-13-11-27)25-20(26-19)28-7-2-3-8-28/h4-5,14H,2-3,6-13H2,1H3,(H2,22,23,24,25,26)