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

Systemtic Name: N-[2-[(4-bromanylthiophen-2-yl)methyl]pyrazol-3-yl]-2-nitro-benzamide Openeye Name: N-[2-[(4-bromo-2-thienyl)methyl]pyrazol-3-yl]-2-nitro-benzamide CAS Name: N-[2-[(4-bromo-2-thiophenyl)methyl]-3-pyrazolyl]-2-nitrobenzamide IUPAC Name: N-[2-[(4-bromothiophen-2-yl)methyl]pyrazol-3-yl]-2-nitrobenzamide Traditional Name: N-[2-[(4-bromo-2-thienyl)methyl]pyrazol-3-yl]-2-nitro-benzamide Formula: C15H11BrN4O3S MolecularWeight: 407.24184

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C(=C1)C(=O)NC2=CC=NN2CC3=CC(=CS3)Br)[N+](=O)[O-]

Isomeric SMILES

C1=CC=C(C(=C1)C(=O)NC2=CC=NN2CC3=CC(=CS3)Br)[N+](=O)[O-]

InChI

InChI=1S/C15H11BrN4O3S/c16-10-7-11(24-9-10)8-19-14(5-6-17-19)18-15(21)12-3-1-2-4-13(12)20(22)23/h1-7,9H,8H2,(H,18,21)