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

Systemtic Name: 6-[(1-butyl-4,5-dimethyl-imidazol-2-yl)sulfanylmethyl]-N2-(2-methoxyphenyl)-1,3,5-triazine-2,4-diamine Openeye Name: 6-[(1-butyl-4,5-dimethyl-imidazol-2-yl)sulfanylmethyl]-N2-(2-methoxyphenyl)-1,3,5-triazine-2,4-diamine CAS Name: 6-[[(1-butyl-4,5-dimethyl-2-imidazolyl)thio]methyl]-N2-(2-methoxyphenyl)-1,3,5-triazine-2,4-diamine IUPAC Name: 6-[(1-butyl-4,5-dimethylimidazol-2-yl)sulfanylmethyl]-2-N-(2-methoxyphenyl)-1,3,5-triazine-2,4-diamine Traditional Name: [4-amino-6-[[(1-butyl-4,5-dimethyl-imidazol-2-yl)thio]methyl]-s-triazin-2-yl]-(2-methoxyphenyl)amine Formula: C20H27N7OS MolecularWeight: 413.53968

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Descriptors Computed from Structure

Canonical SMILES:

CCCCN1C(=C(N=C1SCC2=NC(=NC(=N2)NC3=CC=CC=C3OC)N)C)C

Isomeric SMILES

CCCCN1C(=C(N=C1SCC2=NC(=NC(=N2)NC3=CC=CC=C3OC)N)C)C

InChI

InChI=1S/C20H27N7OS/c1-5-6-11-27-14(3)13(2)22-20(27)29-12-17-24-18(21)26-19(25-17)23-15-9-7-8-10-16(15)28-4/h7-10H,5-6,11-12H2,1-4H3,(H3,21,23,24,25,26)