N-[(5-methylfuran-2-yl)methyl]-2-methylsulfonyl-5-thiophen-2-yl-1,2,4-triazol-3-amine

Systemtic Name: N-[(5-methylfuran-2-yl)methyl]-2-methylsulfonyl-5-thiophen-2-yl-1,2,4-triazol-3-amine Openeye Name: N-[(5-methyl-2-furyl)methyl]-2-methylsulfonyl-5-(2-thienyl)-1,2,4-triazol-3-amine CAS Name: N-[(5-methyl-2-furanyl)methyl]-2-methylsulfonyl-5-thiophen-2-yl-1,2,4-triazol-3-amine IUPAC Name: N-[(5-methylfuran-2-yl)methyl]-2-methylsulfonyl-5-thiophen-2-yl-1,2,4-triazol-3-amine Traditional Name: [2-mesyl-5-(2-thienyl)-1,2,4-triazol-3-yl]-[(5-methyl-2-furyl)methyl]amine Formula: C13H14N4O3S2 MolecularWeight: 338.40526

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(O1)CNC2=NC(=NN2S(=O)(=O)C)C3=CC=CS3

Isomeric SMILES

CC1=CC=C(O1)CNC2=NC(=NN2S(=O)(=O)C)C3=CC=CS3

InChI

InChI=1S/C13H14N4O3S2/c1-9-5-6-10(20-9)8-14-13-15-12(11-4-3-7-21-11)16-17(13)22(2,18)19/h3-7H,8H2,1-2H3,(H,14,15,16)