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

Systemtic Name: N-[(5-methylfuran-2-yl)methyl]-2-(phenylsulfonyl)-5-thiophen-2-yl-1,2,4-triazol-3-amine Openeye Name: 2-(benzenesulfonyl)-N-[(5-methyl-2-furyl)methyl]-5-(2-thienyl)-1,2,4-triazol-3-amine CAS Name: 2-(benzenesulfonyl)-N-[(5-methyl-2-furanyl)methyl]-5-thiophen-2-yl-1,2,4-triazol-3-amine IUPAC Name: 2-(benzenesulfonyl)-N-[(5-methylfuran-2-yl)methyl]-5-thiophen-2-yl-1,2,4-triazol-3-amine Traditional Name: [2-besyl-5-(2-thienyl)-1,2,4-triazol-3-yl]-[(5-methyl-2-furyl)methyl]amine Formula: C18H16N4O3S2 MolecularWeight: 400.47464

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(O1)CNC2=NC(=NN2S(=O)(=O)C3=CC=CC=C3)C4=CC=CS4

Isomeric SMILES

CC1=CC=C(O1)CNC2=NC(=NN2S(=O)(=O)C3=CC=CC=C3)C4=CC=CS4

InChI

InChI=1S/C18H16N4O3S2/c1-13-9-10-14(25-13)12-19-18-20-17(16-8-5-11-26-16)21-22(18)27(23,24)15-6-3-2-4-7-15/h2-11H,12H2,1H3,(H,19,20,21)