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

Systemtic Name: 6-[(4-methyl-6-phenyl-pyrimidin-2-yl)sulfanylmethyl]-N2-phenyl-1,3,5-triazine-2,4-diamine Openeye Name: 6-[(4-methyl-6-phenyl-pyrimidin-2-yl)sulfanylmethyl]-N2-phenyl-1,3,5-triazine-2,4-diamine CAS Name: 6-[[(4-methyl-6-phenyl-2-pyrimidinyl)thio]methyl]-N2-phenyl-1,3,5-triazine-2,4-diamine IUPAC Name: 6-[(4-methyl-6-phenylpyrimidin-2-yl)sulfanylmethyl]-2-N-phenyl-1,3,5-triazine-2,4-diamine Traditional Name: [4-amino-6-[[(4-methyl-6-phenyl-pyrimidin-2-yl)thio]methyl]-s-triazin-2-yl]-phenyl-amine Formula: C21H19N7S MolecularWeight: 401.48746

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC(=NC(=C1)C2=CC=CC=C2)SCC3=NC(=NC(=N3)NC4=CC=CC=C4)N

Isomeric SMILES

CC1=NC(=NC(=C1)C2=CC=CC=C2)SCC3=NC(=NC(=N3)NC4=CC=CC=C4)N

InChI

InChI=1S/C21H19N7S/c1-14-12-17(15-8-4-2-5-9-15)25-21(23-14)29-13-18-26-19(22)28-20(27-18)24-16-10-6-3-7-11-16/h2-12H,13H2,1H3,(H3,22,24,26,27,28)