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

Systemtic Name: 6-[(4-chlorophenyl)methylsulfanylmethyl]-N2-(2-methoxyphenyl)-1,3,5-triazine-2,4-diamine Openeye Name: 6-[(4-chlorophenyl)methylsulfanylmethyl]-N2-(2-methoxyphenyl)-1,3,5-triazine-2,4-diamine CAS Name: 6-[[(4-chlorophenyl)methylthio]methyl]-N2-(2-methoxyphenyl)-1,3,5-triazine-2,4-diamine IUPAC Name: 6-[(4-chlorophenyl)methylsulfanylmethyl]-2-N-(2-methoxyphenyl)-1,3,5-triazine-2,4-diamine Traditional Name: [4-amino-6-[[(4-chlorobenzyl)thio]methyl]-s-triazin-2-yl]-(2-methoxyphenyl)amine Formula: C18H18ClN5OS MolecularWeight: 387.88642

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC=C1NC2=NC(=NC(=N2)N)CSCC3=CC=C(C=C3)Cl

Isomeric SMILES

COC1=CC=CC=C1NC2=NC(=NC(=N2)N)CSCC3=CC=C(C=C3)Cl

InChI

InChI=1S/C18H18ClN5OS/c1-25-15-5-3-2-4-14(15)21-18-23-16(22-17(20)24-18)11-26-10-12-6-8-13(19)9-7-12/h2-9H,10-11H2,1H3,(H3,20,21,22,23,24)