N2-tert-butyl-N4-methyl-6-[3-(2-phenoxyethylsulfanyl)-1,2,4-triazol-1-yl]-1,3,5-triazine-2,4-diamine

Systemtic Name: N2-tert-butyl-N4-methyl-6-[3-(2-phenoxyethylsulfanyl)-1,2,4-triazol-1-yl]-1,3,5-triazine-2,4-diamine Openeye Name: N2-tert-butyl-N4-methyl-6-[3-(2-phenoxyethylsulfanyl)-1,2,4-triazol-1-yl]-1,3,5-triazine-2,4-diamine CAS Name: N2-tert-butyl-N4-methyl-6-[3-(2-phenoxyethylthio)-1,2,4-triazol-1-yl]-1,3,5-triazine-2,4-diamine IUPAC Name: 2-N-tert-butyl-4-N-methyl-6-[3-(2-phenoxyethylsulfanyl)-1,2,4-triazol-1-yl]-1,3,5-triazine-2,4-diamine Traditional Name: tert-butyl-[4-(methylamino)-6-[3-(2-phenoxyethylthio)-1,2,4-triazol-1-yl]-s-triazin-2-yl]amine Formula: C18H24N8OS MolecularWeight: 400.50116

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)NC1=NC(=NC(=N1)NC)N2C=NC(=N2)SCCOC3=CC=CC=C3

Isomeric SMILES

CC(C)(C)NC1=NC(=NC(=N1)NC)N2C=NC(=N2)SCCOC3=CC=CC=C3

InChI

InChI=1S/C18H24N8OS/c1-18(2,3)24-15-21-14(19-4)22-16(23-15)26-12-20-17(25-26)28-11-10-27-13-8-6-5-7-9-13/h5-9,12H,10-11H2,1-4H3,(H2,19,21,22,23,24)