N-(2,3-dihydro-1,4-benzodioxin-6-ylcarbamoyl)-2-(1H-1,2,4-triazol-5-ylsulfanyl)ethanamide

Systemtic Name: N-(2,3-dihydro-1,4-benzodioxin-6-ylcarbamoyl)-2-(1H-1,2,4-triazol-5-ylsulfanyl)ethanamide Openeye Name: N-(2,3-dihydro-1,4-benzodioxin-6-ylcarbamoyl)-2-(1H-1,2,4-triazol-5-ylsulfanyl)acetamide CAS Name: N-[(2,3-dihydro-1,4-benzodioxin-6-ylamino)-oxomethyl]-2-(1H-1,2,4-triazol-5-ylthio)acetamide IUPAC Name: N-(2,3-dihydro-1,4-benzodioxin-6-ylcarbamoyl)-2-(1H-1,2,4-triazol-5-ylsulfanyl)acetamide Traditional Name: N-(2,3-dihydro-1,4-benzodioxin-6-ylcarbamoyl)-2-(1H-1,2,4-triazol-5-ylthio)acetamide Formula: C13H13N5O4S MolecularWeight: 335.33842

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Descriptors Computed from Structure

Canonical SMILES:

C1COC2=C(O1)C=CC(=C2)NC(=O)NC(=O)CSC3=NC=NN3

Isomeric SMILES

C1COC2=C(O1)C=CC(=C2)NC(=O)NC(=O)CSC3=NC=NN3

InChI

InChI=1S/C13H13N5O4S/c19-11(6-23-13-14-7-15-18-13)17-12(20)16-8-1-2-9-10(5-8)22-4-3-21-9/h1-2,5,7H,3-4,6H2,(H,14,15,18)(H2,16,17,19,20)