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

Systemtic Name: N-(5-bromanylpyridin-2-yl)-2-[[5-(4-ethyl-5-methyl-thiophen-3-yl)-4-prop-2-enyl-1,2,4-triazol-3-yl]sulfanyl]ethanamide Openeye Name: 2-[[4-allyl-5-(4-ethyl-5-methyl-3-thienyl)-1,2,4-triazol-3-yl]sulfanyl]-N-(5-bromo-2-pyridyl)acetamide CAS Name: N-(5-bromo-2-pyridinyl)-2-[[5-(4-ethyl-5-methyl-3-thiophenyl)-4-prop-2-enyl-1,2,4-triazol-3-yl]thio]acetamide IUPAC Name: N-(5-bromopyridin-2-yl)-2-[[5-(4-ethyl-5-methylthiophen-3-yl)-4-prop-2-enyl-1,2,4-triazol-3-yl]sulfanyl]acetamide Traditional Name: 2-[[4-allyl-5-(4-ethyl-5-methyl-3-thienyl)-1,2,4-triazol-3-yl]thio]-N-(5-bromo-2-pyridyl)acetamide Formula: C19H20BrN5OS2 MolecularWeight: 478.429

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=C(SC=C1C2=NN=C(N2CC=C)SCC(=O)NC3=NC=C(C=C3)Br)C

Isomeric SMILES

CCC1=C(SC=C1C2=NN=C(N2CC=C)SCC(=O)NC3=NC=C(C=C3)Br)C

InChI

InChI=1S/C19H20BrN5OS2/c1-4-8-25-18(15-10-27-12(3)14(15)5-2)23-24-19(25)28-11-17(26)22-16-7-6-13(20)9-21-16/h4,6-7,9-10H,1,5,8,11H2,2-3H3,(H,21,22,26)