6-[2-(3-methyl-4-propan-2-yl-phenoxy)ethylsulfanyl]-1,3,5-triazine-2,4-diamine

Systemtic Name: 6-[2-(3-methyl-4-propan-2-yl-phenoxy)ethylsulfanyl]-1,3,5-triazine-2,4-diamine Openeye Name: 6-[2-(4-isopropyl-3-methyl-phenoxy)ethylsulfanyl]-1,3,5-triazine-2,4-diamine CAS Name: 6-[2-(3-methyl-4-propan-2-ylphenoxy)ethylthio]-1,3,5-triazine-2,4-diamine IUPAC Name: 6-[2-(3-methyl-4-propan-2-ylphenoxy)ethylsulfanyl]-1,3,5-triazine-2,4-diamine Traditional Name: [4-amino-6-[2-(4-isopropyl-3-methyl-phenoxy)ethylthio]-s-triazin-2-yl]amine Formula: C15H21N5OS MolecularWeight: 319.42514

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1)OCCSC2=NC(=NC(=N2)N)N)C(C)C

Isomeric SMILES

CC1=C(C=CC(=C1)OCCSC2=NC(=NC(=N2)N)N)C(C)C

InChI

InChI=1S/C15H21N5OS/c1-9(2)12-5-4-11(8-10(12)3)21-6-7-22-15-19-13(16)18-14(17)20-15/h4-5,8-9H,6-7H2,1-3H3,(H4,16,17,18,19,20)