6-[(3,4-dimethylphenyl)sulfanylmethyl]-N2-(2-methylphenyl)-1,3,5-triazine-2,4-diamine

Systemtic Name: 6-[(3,4-dimethylphenyl)sulfanylmethyl]-N2-(2-methylphenyl)-1,3,5-triazine-2,4-diamine Openeye Name: 6-[(3,4-dimethylphenyl)sulfanylmethyl]-N2-(o-tolyl)-1,3,5-triazine-2,4-diamine CAS Name: 6-[[(3,4-dimethylphenyl)thio]methyl]-N2-(2-methylphenyl)-1,3,5-triazine-2,4-diamine IUPAC Name: 6-[(3,4-dimethylphenyl)sulfanylmethyl]-2-N-(2-methylphenyl)-1,3,5-triazine-2,4-diamine Traditional Name: [4-amino-6-[[(3,4-dimethylphenyl)thio]methyl]-s-triazin-2-yl]-(o-tolyl)amine Formula: C19H21N5S MolecularWeight: 351.46854

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)SCC2=NC(=NC(=N2)NC3=CC=CC=C3C)N)C

Isomeric SMILES

CC1=C(C=C(C=C1)SCC2=NC(=NC(=N2)NC3=CC=CC=C3C)N)C

InChI

InChI=1S/C19H21N5S/c1-12-8-9-15(10-14(12)3)25-11-17-22-18(20)24-19(23-17)21-16-7-5-4-6-13(16)2/h4-10H,11H2,1-3H3,(H3,20,21,22,23,24)