2-[[5-(4-bromanyl-5-ethyl-thiophen-2-yl)-4-ethyl-1,2,4-triazol-3-yl]sulfanyl]-N-(2-methylpropyl)ethanamide

Systemtic Name: 2-[[5-(4-bromanyl-5-ethyl-thiophen-2-yl)-4-ethyl-1,2,4-triazol-3-yl]sulfanyl]-N-(2-methylpropyl)ethanamide Openeye Name: 2-[[5-(4-bromo-5-ethyl-2-thienyl)-4-ethyl-1,2,4-triazol-3-yl]sulfanyl]-N-isobutyl-acetamide CAS Name: 2-[[5-(4-bromo-5-ethyl-2-thiophenyl)-4-ethyl-1,2,4-triazol-3-yl]thio]-N-(2-methylpropyl)acetamide IUPAC Name: 2-[[5-(4-bromo-5-ethylthiophen-2-yl)-4-ethyl-1,2,4-triazol-3-yl]sulfanyl]-N-(2-methylpropyl)acetamide Traditional Name: 2-[[5-(4-bromo-5-ethyl-2-thienyl)-4-ethyl-1,2,4-triazol-3-yl]thio]-N-isobutyl-acetamide Formula: C16H23BrN4OS2 MolecularWeight: 431.41402

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=C(C=C(S1)C2=NN=C(N2CC)SCC(=O)NCC(C)C)Br

Isomeric SMILES

CCC1=C(C=C(S1)C2=NN=C(N2CC)SCC(=O)NCC(C)C)Br

InChI

InChI=1S/C16H23BrN4OS2/c1-5-12-11(17)7-13(24-12)15-19-20-16(21(15)6-2)23-9-14(22)18-8-10(3)4/h7,10H,5-6,8-9H2,1-4H3,(H,18,22)