N2-(2-methoxyphenyl)-6-[3-(3-methylphenoxy)propylsulfanylmethyl]-1,3,5-triazine-2,4-diamine

Systemtic Name: N2-(2-methoxyphenyl)-6-[3-(3-methylphenoxy)propylsulfanylmethyl]-1,3,5-triazine-2,4-diamine Openeye Name: N2-(2-methoxyphenyl)-6-[3-(3-methylphenoxy)propylsulfanylmethyl]-1,3,5-triazine-2,4-diamine CAS Name: N2-(2-methoxyphenyl)-6-[[3-(3-methylphenoxy)propylthio]methyl]-1,3,5-triazine-2,4-diamine IUPAC Name: 2-N-(2-methoxyphenyl)-6-[3-(3-methylphenoxy)propylsulfanylmethyl]-1,3,5-triazine-2,4-diamine Traditional Name: [4-amino-6-[[3-(3-methylphenoxy)propylthio]methyl]-s-triazin-2-yl]-(2-methoxyphenyl)amine Formula: C21H25N5O2S MolecularWeight: 411.5205

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC=C1)OCCCSCC2=NC(=NC(=N2)NC3=CC=CC=C3OC)N

Isomeric SMILES

CC1=CC(=CC=C1)OCCCSCC2=NC(=NC(=N2)NC3=CC=CC=C3OC)N

InChI

InChI=1S/C21H25N5O2S/c1-15-7-5-8-16(13-15)28-11-6-12-29-14-19-24-20(22)26-21(25-19)23-17-9-3-4-10-18(17)27-2/h3-5,7-10,13H,6,11-12,14H2,1-2H3,(H3,22,23,24,25,26)