N-[(5-bromanylthiophen-2-yl)methyl]-2-[(5-methyl-1H-1,2,4-triazol-3-yl)sulfanyl]-N-prop-2-enyl-ethanamide

Systemtic Name: N-[(5-bromanylthiophen-2-yl)methyl]-2-[(5-methyl-1H-1,2,4-triazol-3-yl)sulfanyl]-N-prop-2-enyl-ethanamide Openeye Name: N-allyl-N-[(5-bromo-2-thienyl)methyl]-2-[(5-methyl-1H-1,2,4-triazol-3-yl)sulfanyl]acetamide CAS Name: N-[(5-bromo-2-thiophenyl)methyl]-2-[(5-methyl-1H-1,2,4-triazol-3-yl)thio]-N-prop-2-enylacetamide IUPAC Name: N-[(5-bromothiophen-2-yl)methyl]-2-[(5-methyl-1H-1,2,4-triazol-3-yl)sulfanyl]-N-prop-2-enylacetamide Traditional Name: N-allyl-N-[(5-bromo-2-thienyl)methyl]-2-[(5-methyl-1H-1,2,4-triazol-3-yl)thio]acetamide Formula: C13H15BrN4OS2 MolecularWeight: 387.3184

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC(=NN1)SCC(=O)N(CC=C)CC2=CC=C(S2)Br

Isomeric SMILES

CC1=NC(=NN1)SCC(=O)N(CC=C)CC2=CC=C(S2)Br

InChI

InChI=1S/C13H15BrN4OS2/c1-3-6-18(7-10-4-5-11(14)21-10)12(19)8-20-13-15-9(2)16-17-13/h3-5H,1,6-8H2,2H3,(H,15,16,17)