N-(2,3-dihydro-1,4-benzodioxin-3-ylmethylcarbamoyl)-2-[(4-phenyl-1,2,4-triazol-3-yl)sulfanyl]ethanamide

Systemtic Name: N-(2,3-dihydro-1,4-benzodioxin-3-ylmethylcarbamoyl)-2-[(4-phenyl-1,2,4-triazol-3-yl)sulfanyl]ethanamide Openeye Name: N-(2,3-dihydro-1,4-benzodioxin-3-ylmethylcarbamoyl)-2-[(4-phenyl-1,2,4-triazol-3-yl)sulfanyl]acetamide CAS Name: N-[(2,3-dihydro-1,4-benzodioxin-3-ylmethylamino)-oxomethyl]-2-[(4-phenyl-1,2,4-triazol-3-yl)thio]acetamide IUPAC Name: N-(2,3-dihydro-1,4-benzodioxin-3-ylmethylcarbamoyl)-2-[(4-phenyl-1,2,4-triazol-3-yl)sulfanyl]acetamide Traditional Name: N-(2,3-dihydro-1,4-benzodioxin-3-ylmethylcarbamoyl)-2-[(4-phenyl-1,2,4-triazol-3-yl)thio]acetamide Formula: C20H19N5O4S MolecularWeight: 425.46096

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1C(OC2=CC=CC=C2O1)CNC(=O)NC(=O)CSC3=NN=CN3C4=CC=CC=C4

Isomeric SMILES

C1C(OC2=CC=CC=C2O1)CNC(=O)NC(=O)CSC3=NN=CN3C4=CC=CC=C4

InChI

InChI=1S/C20H19N5O4S/c26-18(12-30-20-24-22-13-25(20)14-6-2-1-3-7-14)23-19(27)21-10-15-11-28-16-8-4-5-9-17(16)29-15/h1-9,13,15H,10-12H2,(H2,21,23,26,27)