N-[2-[(4-bromanylthiophen-2-yl)methyl]pyrazol-3-yl]-2-(2,5-dimethylphenoxy)ethanamide

Systemtic Name: N-[2-[(4-bromanylthiophen-2-yl)methyl]pyrazol-3-yl]-2-(2,5-dimethylphenoxy)ethanamide Openeye Name: N-[2-[(4-bromo-2-thienyl)methyl]pyrazol-3-yl]-2-(2,5-dimethylphenoxy)acetamide CAS Name: N-[2-[(4-bromo-2-thiophenyl)methyl]-3-pyrazolyl]-2-(2,5-dimethylphenoxy)acetamide IUPAC Name: N-[2-[(4-bromothiophen-2-yl)methyl]pyrazol-3-yl]-2-(2,5-dimethylphenoxy)acetamide Traditional Name: N-[2-[(4-bromo-2-thienyl)methyl]pyrazol-3-yl]-2-(2,5-dimethylphenoxy)acetamide Formula: C18H18BrN3O2S MolecularWeight: 420.32342

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)C)OCC(=O)NC2=CC=NN2CC3=CC(=CS3)Br

Isomeric SMILES

CC1=CC(=C(C=C1)C)OCC(=O)NC2=CC=NN2CC3=CC(=CS3)Br

InChI

InChI=1S/C18H18BrN3O2S/c1-12-3-4-13(2)16(7-12)24-10-18(23)21-17-5-6-20-22(17)9-15-8-14(19)11-25-15/h3-8,11H,9-10H2,1-2H3,(H,21,23)