6-chloranyl-N2-(4-iodanyl-2-methyl-phenyl)-N4-prop-2-enyl-1,3,5-triazine-2,4-diamine

Systemtic Name: 6-chloranyl-N2-(4-iodanyl-2-methyl-phenyl)-N4-prop-2-enyl-1,3,5-triazine-2,4-diamine Openeye Name: N4-allyl-6-chloro-N2-(4-iodo-2-methyl-phenyl)-1,3,5-triazine-2,4-diamine CAS Name: 6-chloro-N2-(4-iodo-2-methylphenyl)-N4-prop-2-enyl-1,3,5-triazine-2,4-diamine IUPAC Name: 6-chloro-2-N-(4-iodo-2-methylphenyl)-4-N-prop-2-enyl-1,3,5-triazine-2,4-diamine Traditional Name: allyl-[4-chloro-6-(4-iodo-2-methyl-anilino)-s-triazin-2-yl]amine Formula: C13H13ClIN5 MolecularWeight: 401.63329

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1)I)NC2=NC(=NC(=N2)Cl)NCC=C

Isomeric SMILES

CC1=C(C=CC(=C1)I)NC2=NC(=NC(=N2)Cl)NCC=C

InChI

InChI=1S/C13H13ClIN5/c1-3-6-16-12-18-11(14)19-13(20-12)17-10-5-4-9(15)7-8(10)2/h3-5,7H,1,6H2,2H3,(H2,16,17,18,19,20)