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

Systemtic Name: 6-[3-(4-methoxyphenoxy)propylsulfanylmethyl]-N2-(2-methoxyphenyl)-1,3,5-triazine-2,4-diamine Openeye Name: 6-[3-(4-methoxyphenoxy)propylsulfanylmethyl]-N2-(2-methoxyphenyl)-1,3,5-triazine-2,4-diamine CAS Name: 6-[[3-(4-methoxyphenoxy)propylthio]methyl]-N2-(2-methoxyphenyl)-1,3,5-triazine-2,4-diamine IUPAC Name: 6-[3-(4-methoxyphenoxy)propylsulfanylmethyl]-2-N-(2-methoxyphenyl)-1,3,5-triazine-2,4-diamine Traditional Name: [4-amino-6-[[3-(4-methoxyphenoxy)propylthio]methyl]-s-triazin-2-yl]-(2-methoxyphenyl)amine Formula: C21H25N5O3S MolecularWeight: 427.5199

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)OCCCSCC2=NC(=NC(=N2)NC3=CC=CC=C3OC)N

Isomeric SMILES

COC1=CC=C(C=C1)OCCCSCC2=NC(=NC(=N2)NC3=CC=CC=C3OC)N

InChI

InChI=1S/C21H25N5O3S/c1-27-15-8-10-16(11-9-15)29-12-5-13-30-14-19-24-20(22)26-21(25-19)23-17-6-3-4-7-18(17)28-2/h3-4,6-11H,5,12-14H2,1-2H3,(H3,22,23,24,25,26)