4-(aminomethyl)-N-[4-(4-bromanylpyrazol-1-yl)phenyl]benzamide

Systemtic Name: 4-(aminomethyl)-N-[4-(4-bromanylpyrazol-1-yl)phenyl]benzamide Openeye Name: 4-(aminomethyl)-N-[4-(4-bromopyrazol-1-yl)phenyl]benzamide CAS Name: 4-(aminomethyl)-N-[4-(4-bromo-1-pyrazolyl)phenyl]benzamide IUPAC Name: 4-(aminomethyl)-N-[4-(4-bromopyrazol-1-yl)phenyl]benzamide Traditional Name: 4-(aminomethyl)-N-[4-(4-bromopyrazol-1-yl)phenyl]benzamide Formula: C17H15BrN4O MolecularWeight: 371.2312

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1CN)C(=O)NC2=CC=C(C=C2)N3C=C(C=N3)Br

Isomeric SMILES

C1=CC(=CC=C1CN)C(=O)NC2=CC=C(C=C2)N3C=C(C=N3)Br

InChI

InChI=1S/C17H15BrN4O/c18-14-10-20-22(11-14)16-7-5-15(6-8-16)21-17(23)13-3-1-12(9-19)2-4-13/h1-8,10-11H,9,19H2,(H,21,23)