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

Systemtic Name: N2-phenyl-6-[(4-phenyl-1,2,4-triazol-3-yl)sulfanylmethyl]-1,3,5-triazine-2,4-diamine Openeye Name: N2-phenyl-6-[(4-phenyl-1,2,4-triazol-3-yl)sulfanylmethyl]-1,3,5-triazine-2,4-diamine CAS Name: N2-phenyl-6-[[(4-phenyl-1,2,4-triazol-3-yl)thio]methyl]-1,3,5-triazine-2,4-diamine IUPAC Name: 2-N-phenyl-6-[(4-phenyl-1,2,4-triazol-3-yl)sulfanylmethyl]-1,3,5-triazine-2,4-diamine Traditional Name: [4-amino-6-[[(4-phenyl-1,2,4-triazol-3-yl)thio]methyl]-s-triazin-2-yl]-phenyl-amine Formula: C18H16N8S MolecularWeight: 376.43824

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)NC2=NC(=NC(=N2)N)CSC3=NN=CN3C4=CC=CC=C4

Isomeric SMILES

C1=CC=C(C=C1)NC2=NC(=NC(=N2)N)CSC3=NN=CN3C4=CC=CC=C4

InChI

InChI=1S/C18H16N8S/c19-16-22-15(23-17(24-16)21-13-7-3-1-4-8-13)11-27-18-25-20-12-26(18)14-9-5-2-6-10-14/h1-10,12H,11H2,(H3,19,21,22,23,24)