N-(prop-2-enylcarbamoyl)-2-[(5-thiophen-2-yl-1H-1,2,4-triazol-3-yl)sulfanyl]ethanamide

Systemtic Name: N-(prop-2-enylcarbamoyl)-2-[(5-thiophen-2-yl-1H-1,2,4-triazol-3-yl)sulfanyl]ethanamide Openeye Name: N-(allylcarbamoyl)-2-[[5-(2-thienyl)-1H-1,2,4-triazol-3-yl]sulfanyl]acetamide CAS Name: N-[oxo-(prop-2-enylamino)methyl]-2-[(5-thiophen-2-yl-1H-1,2,4-triazol-3-yl)thio]acetamide IUPAC Name: N-(prop-2-enylcarbamoyl)-2-[(5-thiophen-2-yl-1H-1,2,4-triazol-3-yl)sulfanyl]acetamide Traditional Name: N-(allylcarbamoyl)-2-[[5-(2-thienyl)-1H-1,2,4-triazol-3-yl]thio]acetamide Formula: C12H13N5O2S2 MolecularWeight: 323.39392

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Descriptors Computed from Structure

Canonical SMILES:

C=CCNC(=O)NC(=O)CSC1=NNC(=N1)C2=CC=CS2

Isomeric SMILES

C=CCNC(=O)NC(=O)CSC1=NNC(=N1)C2=CC=CS2

InChI

InChI=1S/C12H13N5O2S2/c1-2-5-13-11(19)14-9(18)7-21-12-15-10(16-17-12)8-4-3-6-20-8/h2-4,6H,1,5,7H2,(H,15,16,17)(H2,13,14,18,19)