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

Systemtic Name: N-[2-[(4-bromanylthiophen-2-yl)methyl]pyrazol-3-yl]-2-(3,4-dimethylphenyl)ethanamide Openeye Name: N-[2-[(4-bromo-2-thienyl)methyl]pyrazol-3-yl]-2-(3,4-dimethylphenyl)acetamide CAS Name: N-[2-[(4-bromo-2-thiophenyl)methyl]-3-pyrazolyl]-2-(3,4-dimethylphenyl)acetamide IUPAC Name: N-[2-[(4-bromothiophen-2-yl)methyl]pyrazol-3-yl]-2-(3,4-dimethylphenyl)acetamide Traditional Name: N-[2-[(4-bromo-2-thienyl)methyl]pyrazol-3-yl]-2-(3,4-dimethylphenyl)acetamide Formula: C18H18BrN3OS MolecularWeight: 404.32402

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C18H18BrN3OS/c1-12-3-4-14(7-13(12)2)8-18(23)21-17-5-6-20-22(17)10-16-9-15(19)11-24-16/h3-7,9,11H,8,10H2,1-2H3,(H,21,23)