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

Systemtic Name: N-[(4-bromanyl-2-ethyl-pyrazol-3-yl)methyl]-4-[(3-methylphenoxy)methyl]thiophene-2-carboxamide Openeye Name: N-[(4-bromo-2-ethyl-pyrazol-3-yl)methyl]-4-[(3-methylphenoxy)methyl]thiophene-2-carboxamide CAS Name: N-[(4-bromo-2-ethyl-3-pyrazolyl)methyl]-4-[(3-methylphenoxy)methyl]-2-thiophenecarboxamide IUPAC Name: N-[(4-bromo-2-ethylpyrazol-3-yl)methyl]-4-[(3-methylphenoxy)methyl]thiophene-2-carboxamide Traditional Name: N-[(4-bromo-2-ethyl-pyrazol-3-yl)methyl]-4-[(3-methylphenoxy)methyl]thiophene-2-carboxamide Formula: C19H20BrN3O2S MolecularWeight: 434.35

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C19H20BrN3O2S/c1-3-23-17(16(20)9-22-23)10-21-19(24)18-8-14(12-26-18)11-25-15-6-4-5-13(2)7-15/h4-9,12H,3,10-11H2,1-2H3,(H,21,24)