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

Systemtic Name: 6-[[5-phenyl-1-(4-propan-2-ylphenyl)imidazol-2-yl]sulfanylmethyl]-1,3,5-triazine-2,4-diamine Openeye Name: 6-[[1-(4-isopropylphenyl)-5-phenyl-imidazol-2-yl]sulfanylmethyl]-1,3,5-triazine-2,4-diamine CAS Name: 6-[[[5-phenyl-1-(4-propan-2-ylphenyl)-2-imidazolyl]thio]methyl]-1,3,5-triazine-2,4-diamine IUPAC Name: 6-[[5-phenyl-1-(4-propan-2-ylphenyl)imidazol-2-yl]sulfanylmethyl]-1,3,5-triazine-2,4-diamine Traditional Name: [4-amino-6-[[(1-p-cumenyl-5-phenyl-imidazol-2-yl)thio]methyl]-s-triazin-2-yl]amine Formula: C22H23N7S MolecularWeight: 417.52992

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C22H23N7S/c1-14(2)15-8-10-17(11-9-15)29-18(16-6-4-3-5-7-16)12-25-22(29)30-13-19-26-20(23)28-21(24)27-19/h3-12,14H,13H2,1-2H3,(H4,23,24,26,27,28)