N-[2-(2-bromanyl-4,5-dimethoxy-phenyl)ethyl]-2-(3-propyl-5-sulfanylidene-1H-1,2,4-triazol-4-yl)ethanamide

Systemtic Name: N-[2-(2-bromanyl-4,5-dimethoxy-phenyl)ethyl]-2-(3-propyl-5-sulfanylidene-1H-1,2,4-triazol-4-yl)ethanamide Openeye Name: N-[2-(2-bromo-4,5-dimethoxy-phenyl)ethyl]-2-(3-propyl-5-thioxo-1H-1,2,4-triazol-4-yl)acetamide CAS Name: N-[2-(2-bromo-4,5-dimethoxyphenyl)ethyl]-2-(3-propyl-5-sulfanylidene-1H-1,2,4-triazol-4-yl)acetamide IUPAC Name: N-[2-(2-bromo-4,5-dimethoxyphenyl)ethyl]-2-(3-propyl-5-sulfanylidene-1H-1,2,4-triazol-4-yl)acetamide Traditional Name: N-[2-(2-bromo-4,5-dimethoxy-phenyl)ethyl]-2-(3-propyl-5-thioxo-1H-1,2,4-triazol-4-yl)acetamide Formula: C17H23BrN4O3S MolecularWeight: 443.35852

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Descriptors Computed from Structure

Canonical SMILES:

CCCC1=NNC(=S)N1CC(=O)NCCC2=CC(=C(C=C2Br)OC)OC

Isomeric SMILES

CCCC1=NNC(=S)N1CC(=O)NCCC2=CC(=C(C=C2Br)OC)OC

InChI

InChI=1S/C17H23BrN4O3S/c1-4-5-15-20-21-17(26)22(15)10-16(23)19-7-6-11-8-13(24-2)14(25-3)9-12(11)18/h8-9H,4-7,10H2,1-3H3,(H,19,23)(H,21,26)