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

Systemtic Name: N2-phenyl-6-[(5-thiophen-2-yl-1H-1,2,4-triazol-3-yl)sulfanylmethyl]-1,3,5-triazine-2,4-diamine Openeye Name: N2-phenyl-6-[[5-(2-thienyl)-1H-1,2,4-triazol-3-yl]sulfanylmethyl]-1,3,5-triazine-2,4-diamine CAS Name: N2-phenyl-6-[[(5-thiophen-2-yl-1H-1,2,4-triazol-3-yl)thio]methyl]-1,3,5-triazine-2,4-diamine IUPAC Name: 2-N-phenyl-6-[(5-thiophen-2-yl-1H-1,2,4-triazol-3-yl)sulfanylmethyl]-1,3,5-triazine-2,4-diamine Traditional Name: [4-amino-6-[[[5-(2-thienyl)-1H-1,2,4-triazol-3-yl]thio]methyl]-s-triazin-2-yl]-phenyl-amine Formula: C16H14N8S2 MolecularWeight: 382.46596

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)NC2=NC(=NC(=N2)N)CSC3=NNC(=N3)C4=CC=CS4

Isomeric SMILES

C1=CC=C(C=C1)NC2=NC(=NC(=N2)N)CSC3=NNC(=N3)C4=CC=CS4

InChI

InChI=1S/C16H14N8S2/c17-14-19-12(20-15(22-14)18-10-5-2-1-3-6-10)9-26-16-21-13(23-24-16)11-7-4-8-25-11/h1-8H,9H2,(H,21,23,24)(H3,17,18,19,20,22)