1-[(2-bromanyl-4-chloranyl-phenoxy)methyl]-N-[1-(4-methylphenyl)propyl]pyrazole-3-carboxamide

Systemtic Name: 1-[(2-bromanyl-4-chloranyl-phenoxy)methyl]-N-[1-(4-methylphenyl)propyl]pyrazole-3-carboxamide Openeye Name: 1-[(2-bromo-4-chloro-phenoxy)methyl]-N-[1-(p-tolyl)propyl]pyrazole-3-carboxamide CAS Name: 1-[(2-bromo-4-chlorophenoxy)methyl]-N-[1-(4-methylphenyl)propyl]-3-pyrazolecarboxamide IUPAC Name: 1-[(2-bromo-4-chlorophenoxy)methyl]-N-[1-(4-methylphenyl)propyl]pyrazole-3-carboxamide Traditional Name: 1-[(2-bromo-4-chloro-phenoxy)methyl]-N-[1-(p-tolyl)propyl]pyrazole-3-carboxamide Formula: C21H21BrClN3O2 MolecularWeight: 462.76734

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C1=CC=C(C=C1)C)NC(=O)C2=NN(C=C2)COC3=C(C=C(C=C3)Cl)Br

Isomeric SMILES

CCC(C1=CC=C(C=C1)C)NC(=O)C2=NN(C=C2)COC3=C(C=C(C=C3)Cl)Br

InChI

InChI=1S/C21H21BrClN3O2/c1-3-18(15-6-4-14(2)5-7-15)24-21(27)19-10-11-26(25-19)13-28-20-9-8-16(23)12-17(20)22/h4-12,18H,3,13H2,1-2H3,(H,24,27)