N-(1,3-benzodioxol-5-yl)-2-[(5-methyl-1H-1,2,4-triazol-3-yl)sulfanyl]propanamide

Systemtic Name: N-(1,3-benzodioxol-5-yl)-2-[(5-methyl-1H-1,2,4-triazol-3-yl)sulfanyl]propanamide Openeye Name: N-(1,3-benzodioxol-5-yl)-2-[(5-methyl-1H-1,2,4-triazol-3-yl)sulfanyl]propanamide CAS Name: N-(1,3-benzodioxol-5-yl)-2-[(5-methyl-1H-1,2,4-triazol-3-yl)thio]propanamide IUPAC Name: N-(1,3-benzodioxol-5-yl)-2-[(5-methyl-1H-1,2,4-triazol-3-yl)sulfanyl]propanamide Traditional Name: N-(1,3-benzodioxol-5-yl)-2-[(5-methyl-1H-1,2,4-triazol-3-yl)thio]propionamide Formula: C13H14N4O3S MolecularWeight: 306.34026

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=NC(=NN1)SC(C)C(=O)NC2=CC3=C(C=C2)OCO3

Isomeric SMILES

CC1=NC(=NN1)SC(C)C(=O)NC2=CC3=C(C=C2)OCO3

InChI

InChI=1S/C13H14N4O3S/c1-7(21-13-14-8(2)16-17-13)12(18)15-9-3-4-10-11(5-9)20-6-19-10/h3-5,7H,6H2,1-2H3,(H,15,18)(H,14,16,17)