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

Systemtic Name: 6-[(4-bromophenyl)sulfanylmethyl]-N2-(2-methoxyphenyl)-1,3,5-triazine-2,4-diamine Openeye Name: 6-[(4-bromophenyl)sulfanylmethyl]-N2-(2-methoxyphenyl)-1,3,5-triazine-2,4-diamine CAS Name: 6-[[(4-bromophenyl)thio]methyl]-N2-(2-methoxyphenyl)-1,3,5-triazine-2,4-diamine IUPAC Name: 6-[(4-bromophenyl)sulfanylmethyl]-2-N-(2-methoxyphenyl)-1,3,5-triazine-2,4-diamine Traditional Name: [4-amino-6-[[(4-bromophenyl)thio]methyl]-s-triazin-2-yl]-(2-methoxyphenyl)amine Formula: C17H16BrN5OS MolecularWeight: 418.31084

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC=C1NC2=NC(=NC(=N2)N)CSC3=CC=C(C=C3)Br

Isomeric SMILES

COC1=CC=CC=C1NC2=NC(=NC(=N2)N)CSC3=CC=C(C=C3)Br

InChI

InChI=1S/C17H16BrN5OS/c1-24-14-5-3-2-4-13(14)20-17-22-15(21-16(19)23-17)10-25-12-8-6-11(18)7-9-12/h2-9H,10H2,1H3,(H3,19,20,21,22,23)