N-[4-bromanyl-1-[(3-methylphenyl)methyl]pyrazol-3-yl]-2-chloranyl-benzamide

Systemtic Name: N-[4-bromanyl-1-[(3-methylphenyl)methyl]pyrazol-3-yl]-2-chloranyl-benzamide Openeye Name: N-[4-bromo-1-(m-tolylmethyl)pyrazol-3-yl]-2-chloro-benzamide CAS Name: N-[4-bromo-1-[(3-methylphenyl)methyl]-3-pyrazolyl]-2-chlorobenzamide IUPAC Name: N-[4-bromo-1-[(3-methylphenyl)methyl]pyrazol-3-yl]-2-chlorobenzamide Traditional Name: N-[4-bromo-1-(3-methylbenzyl)pyrazol-3-yl]-2-chloro-benzamide Formula: C18H15BrClN3O MolecularWeight: 404.6882

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC=C1)CN2C=C(C(=N2)NC(=O)C3=CC=CC=C3Cl)Br

Isomeric SMILES

CC1=CC(=CC=C1)CN2C=C(C(=N2)NC(=O)C3=CC=CC=C3Cl)Br

InChI

InChI=1S/C18H15BrClN3O/c1-12-5-4-6-13(9-12)10-23-11-15(19)17(22-23)21-18(24)14-7-2-3-8-16(14)20/h2-9,11H,10H2,1H3,(H,21,22,24)