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

Systemtic Name: N-[(5-bromanylthiophen-2-yl)methyl]-2-[(5-ethyl-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-ethyl-1H-1,2,4-triazol-3-yl)sulfanyl]acetamide CAS Name: N-[(5-bromo-2-thiophenyl)methyl]-2-[(5-ethyl-1H-1,2,4-triazol-3-yl)thio]-N-prop-2-enylacetamide IUPAC Name: N-[(5-bromothiophen-2-yl)methyl]-2-[(5-ethyl-1H-1,2,4-triazol-3-yl)sulfanyl]-N-prop-2-enylacetamide Traditional Name: N-allyl-N-[(5-bromo-2-thienyl)methyl]-2-[(5-ethyl-1H-1,2,4-triazol-3-yl)thio]acetamide Formula: C14H17BrN4OS2 MolecularWeight: 401.34498

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=NC(=NN1)SCC(=O)N(CC=C)CC2=CC=C(S2)Br

Isomeric SMILES

CCC1=NC(=NN1)SCC(=O)N(CC=C)CC2=CC=C(S2)Br

InChI

InChI=1S/C14H17BrN4OS2/c1-3-7-19(8-10-5-6-11(15)22-10)13(20)9-21-14-16-12(4-2)17-18-14/h3,5-6H,1,4,7-9H2,2H3,(H,16,17,18)