N-[2-[(4-bromanylthiophen-2-yl)methyl]pyrazol-3-yl]-4-ethyl-benzamide

Systemtic Name: N-[2-[(4-bromanylthiophen-2-yl)methyl]pyrazol-3-yl]-4-ethyl-benzamide Openeye Name: N-[2-[(4-bromo-2-thienyl)methyl]pyrazol-3-yl]-4-ethyl-benzamide CAS Name: N-[2-[(4-bromo-2-thiophenyl)methyl]-3-pyrazolyl]-4-ethylbenzamide IUPAC Name: N-[2-[(4-bromothiophen-2-yl)methyl]pyrazol-3-yl]-4-ethylbenzamide Traditional Name: N-[2-[(4-bromo-2-thienyl)methyl]pyrazol-3-yl]-4-ethyl-benzamide Formula: C17H16BrN3OS MolecularWeight: 390.29744

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC=C(C=C1)C(=O)NC2=CC=NN2CC3=CC(=CS3)Br

Isomeric SMILES

CCC1=CC=C(C=C1)C(=O)NC2=CC=NN2CC3=CC(=CS3)Br

InChI

InChI=1S/C17H16BrN3OS/c1-2-12-3-5-13(6-4-12)17(22)20-16-7-8-19-21(16)10-15-9-14(18)11-23-15/h3-9,11H,2,10H2,1H3,(H,20,22)