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

Systemtic Name: 6-[[1-(3-methoxyphenyl)imidazol-2-yl]sulfanylmethyl]-N2-phenyl-1,3,5-triazine-2,4-diamine Openeye Name: 6-[[1-(3-methoxyphenyl)imidazol-2-yl]sulfanylmethyl]-N2-phenyl-1,3,5-triazine-2,4-diamine CAS Name: 6-[[[1-(3-methoxyphenyl)-2-imidazolyl]thio]methyl]-N2-phenyl-1,3,5-triazine-2,4-diamine IUPAC Name: 6-[[1-(3-methoxyphenyl)imidazol-2-yl]sulfanylmethyl]-2-N-phenyl-1,3,5-triazine-2,4-diamine Traditional Name: [4-amino-6-[[[1-(3-methoxyphenyl)imidazol-2-yl]thio]methyl]-s-triazin-2-yl]-phenyl-amine Formula: C20H19N7OS MolecularWeight: 405.47616

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC(=C1)N2C=CN=C2SCC3=NC(=NC(=N3)NC4=CC=CC=C4)N

Isomeric SMILES

COC1=CC=CC(=C1)N2C=CN=C2SCC3=NC(=NC(=N3)NC4=CC=CC=C4)N

InChI

InChI=1S/C20H19N7OS/c1-28-16-9-5-8-15(12-16)27-11-10-22-20(27)29-13-17-24-18(21)26-19(25-17)23-14-6-3-2-4-7-14/h2-12H,13H2,1H3,(H3,21,23,24,25,26)