N-(2,3-dihydro-1,4-benzodioxin-3-ylmethylcarbamoyl)-2-[(5-thiophen-2-yl-1H-1,2,4-triazol-3-yl)sulfanyl]ethanamide

Systemtic Name: N-(2,3-dihydro-1,4-benzodioxin-3-ylmethylcarbamoyl)-2-[(5-thiophen-2-yl-1H-1,2,4-triazol-3-yl)sulfanyl]ethanamide Openeye Name: N-(2,3-dihydro-1,4-benzodioxin-3-ylmethylcarbamoyl)-2-[[5-(2-thienyl)-1H-1,2,4-triazol-3-yl]sulfanyl]acetamide CAS Name: N-[(2,3-dihydro-1,4-benzodioxin-3-ylmethylamino)-oxomethyl]-2-[(5-thiophen-2-yl-1H-1,2,4-triazol-3-yl)thio]acetamide IUPAC Name: N-(2,3-dihydro-1,4-benzodioxin-3-ylmethylcarbamoyl)-2-[(5-thiophen-2-yl-1H-1,2,4-triazol-3-yl)sulfanyl]acetamide Traditional Name: N-(2,3-dihydro-1,4-benzodioxin-3-ylmethylcarbamoyl)-2-[[5-(2-thienyl)-1H-1,2,4-triazol-3-yl]thio]acetamide Formula: C18H17N5O4S2 MolecularWeight: 431.48868

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Descriptors Computed from Structure

Canonical SMILES:

C1C(OC2=CC=CC=C2O1)CNC(=O)NC(=O)CSC3=NNC(=N3)C4=CC=CS4

Isomeric SMILES

C1C(OC2=CC=CC=C2O1)CNC(=O)NC(=O)CSC3=NNC(=N3)C4=CC=CS4

InChI

InChI=1S/C18H17N5O4S2/c24-15(10-29-18-21-16(22-23-18)14-6-3-7-28-14)20-17(25)19-8-11-9-26-12-4-1-2-5-13(12)27-11/h1-7,11H,8-10H2,(H,21,22,23)(H2,19,20,24,25)