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

Systemtic Name: N2-(2-methylphenyl)-6-[(1-methyl-5-phenyl-imidazol-2-yl)sulfanylmethyl]-1,3,5-triazine-2,4-diamine Openeye Name: 6-[(1-methyl-5-phenyl-imidazol-2-yl)sulfanylmethyl]-N2-(o-tolyl)-1,3,5-triazine-2,4-diamine CAS Name: N2-(2-methylphenyl)-6-[[(1-methyl-5-phenyl-2-imidazolyl)thio]methyl]-1,3,5-triazine-2,4-diamine IUPAC Name: 2-N-(2-methylphenyl)-6-[(1-methyl-5-phenylimidazol-2-yl)sulfanylmethyl]-1,3,5-triazine-2,4-diamine Traditional Name: [4-amino-6-[[(1-methyl-5-phenyl-imidazol-2-yl)thio]methyl]-s-triazin-2-yl]-(o-tolyl)amine Formula: C21H21N7S MolecularWeight: 403.50334

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1NC2=NC(=NC(=N2)N)CSC3=NC=C(N3C)C4=CC=CC=C4

Isomeric SMILES

CC1=CC=CC=C1NC2=NC(=NC(=N2)N)CSC3=NC=C(N3C)C4=CC=CC=C4

InChI

InChI=1S/C21H21N7S/c1-14-8-6-7-11-16(14)24-20-26-18(25-19(22)27-20)13-29-21-23-12-17(28(21)2)15-9-4-3-5-10-15/h3-12H,13H2,1-2H3,(H3,22,24,25,26,27)