5-bromanyl-2-chloranyl-N-[4-(1,2,4-triazol-1-ylmethyl)phenyl]benzamide

Systemtic Name: 5-bromanyl-2-chloranyl-N-[4-(1,2,4-triazol-1-ylmethyl)phenyl]benzamide Openeye Name: 5-bromo-2-chloro-N-[4-(1,2,4-triazol-1-ylmethyl)phenyl]benzamide CAS Name: 5-bromo-2-chloro-N-[4-(1,2,4-triazol-1-ylmethyl)phenyl]benzamide IUPAC Name: 5-bromo-2-chloro-N-[4-(1,2,4-triazol-1-ylmethyl)phenyl]benzamide Traditional Name: 5-bromo-2-chloro-N-[4-(1,2,4-triazol-1-ylmethyl)phenyl]benzamide Formula: C16H12BrClN4O MolecularWeight: 391.64968

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1CN2C=NC=N2)NC(=O)C3=C(C=CC(=C3)Br)Cl

Isomeric SMILES

C1=CC(=CC=C1CN2C=NC=N2)NC(=O)C3=C(C=CC(=C3)Br)Cl

InChI

InChI=1S/C16H12BrClN4O/c17-12-3-6-15(18)14(7-12)16(23)21-13-4-1-11(2-5-13)8-22-10-19-9-20-22/h1-7,9-10H,8H2,(H,21,23)