N-[(4-bromanyl-2-ethyl-pyrazol-3-yl)methyl]-4-[(2,5-dimethylphenoxy)methyl]thiophene-2-carboxamide

Systemtic Name: N-[(4-bromanyl-2-ethyl-pyrazol-3-yl)methyl]-4-[(2,5-dimethylphenoxy)methyl]thiophene-2-carboxamide Openeye Name: N-[(4-bromo-2-ethyl-pyrazol-3-yl)methyl]-4-[(2,5-dimethylphenoxy)methyl]thiophene-2-carboxamide CAS Name: N-[(4-bromo-2-ethyl-3-pyrazolyl)methyl]-4-[(2,5-dimethylphenoxy)methyl]-2-thiophenecarboxamide IUPAC Name: N-[(4-bromo-2-ethylpyrazol-3-yl)methyl]-4-[(2,5-dimethylphenoxy)methyl]thiophene-2-carboxamide Traditional Name: N-[(4-bromo-2-ethyl-pyrazol-3-yl)methyl]-4-[(2,5-dimethylphenoxy)methyl]thiophene-2-carboxamide Formula: C20H22BrN3O2S MolecularWeight: 448.37658

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCN1C(=C(C=N1)Br)CNC(=O)C2=CC(=CS2)COC3=C(C=CC(=C3)C)C

Isomeric SMILES

CCN1C(=C(C=N1)Br)CNC(=O)C2=CC(=CS2)COC3=C(C=CC(=C3)C)C

InChI

InChI=1S/C20H22BrN3O2S/c1-4-24-17(16(21)9-23-24)10-22-20(25)19-8-15(12-27-19)11-26-18-7-13(2)5-6-14(18)3/h5-9,12H,4,10-11H2,1-3H3,(H,22,25)