2-methylsulfonyl-N-(phenylmethyl)-5-thiophen-2-yl-1,2,4-triazol-3-amine

Systemtic Name: 2-methylsulfonyl-N-(phenylmethyl)-5-thiophen-2-yl-1,2,4-triazol-3-amine Openeye Name: N-benzyl-2-methylsulfonyl-5-(2-thienyl)-1,2,4-triazol-3-amine CAS Name: 2-methylsulfonyl-N-(phenylmethyl)-5-thiophen-2-yl-1,2,4-triazol-3-amine IUPAC Name: N-benzyl-2-methylsulfonyl-5-thiophen-2-yl-1,2,4-triazol-3-amine Traditional Name: benzyl-[2-mesyl-5-(2-thienyl)-1,2,4-triazol-3-yl]amine Formula: C14H14N4O2S2 MolecularWeight: 334.41656

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Descriptors Computed from Structure

Canonical SMILES:

CS(=O)(=O)N1C(=NC(=N1)C2=CC=CS2)NCC3=CC=CC=C3

Isomeric SMILES

CS(=O)(=O)N1C(=NC(=N1)C2=CC=CS2)NCC3=CC=CC=C3

InChI

InChI=1S/C14H14N4O2S2/c1-22(19,20)18-14(15-10-11-6-3-2-4-7-11)16-13(17-18)12-8-5-9-21-12/h2-9H,10H2,1H3,(H,15,16,17)