N-[2-(4-bromanyl-3,5-dimethyl-pyrazol-1-yl)ethyl]-4-[(2-fluoranylphenoxy)methyl]thiophene-2-carboxamide

Systemtic Name: N-[2-(4-bromanyl-3,5-dimethyl-pyrazol-1-yl)ethyl]-4-[(2-fluoranylphenoxy)methyl]thiophene-2-carboxamide Openeye Name: N-[2-(4-bromo-3,5-dimethyl-pyrazol-1-yl)ethyl]-4-[(2-fluorophenoxy)methyl]thiophene-2-carboxamide CAS Name: N-[2-(4-bromo-3,5-dimethyl-1-pyrazolyl)ethyl]-4-[(2-fluorophenoxy)methyl]-2-thiophenecarboxamide IUPAC Name: N-[2-(4-bromo-3,5-dimethylpyrazol-1-yl)ethyl]-4-[(2-fluorophenoxy)methyl]thiophene-2-carboxamide Traditional Name: N-[2-(4-bromo-3,5-dimethyl-pyrazol-1-yl)ethyl]-4-[(2-fluorophenoxy)methyl]thiophene-2-carboxamide Formula: C19H19BrFN3O2S MolecularWeight: 452.340463

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=NN1CCNC(=O)C2=CC(=CS2)COC3=CC=CC=C3F)C)Br

Isomeric SMILES

CC1=C(C(=NN1CCNC(=O)C2=CC(=CS2)COC3=CC=CC=C3F)C)Br

InChI

InChI=1S/C19H19BrFN3O2S/c1-12-18(20)13(2)24(23-12)8-7-22-19(25)17-9-14(11-27-17)10-26-16-6-4-3-5-15(16)21/h3-6,9,11H,7-8,10H2,1-2H3,(H,22,25)