N-(1,3-benzodioxol-5-yl)-2-[(4,5-dimethyl-1,2,4-triazol-3-yl)sulfanyl]ethanamide

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

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NN=C(N1C)SCC(=O)NC2=CC3=C(C=C2)OCO3

Isomeric SMILES

CC1=NN=C(N1C)SCC(=O)NC2=CC3=C(C=C2)OCO3

InChI

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