N-[1-[(4-bromanylphenoxy)methyl]pyrazol-4-yl]-3-(4-iodanyl-5-methyl-pyrazol-1-yl)propanamide

Systemtic Name: N-[1-[(4-bromanylphenoxy)methyl]pyrazol-4-yl]-3-(4-iodanyl-5-methyl-pyrazol-1-yl)propanamide Openeye Name: N-[1-[(4-bromophenoxy)methyl]pyrazol-4-yl]-3-(4-iodo-5-methyl-pyrazol-1-yl)propanamide CAS Name: N-[1-[(4-bromophenoxy)methyl]-4-pyrazolyl]-3-(4-iodo-5-methyl-1-pyrazolyl)propanamide IUPAC Name: N-[1-[(4-bromophenoxy)methyl]pyrazol-4-yl]-3-(4-iodo-5-methylpyrazol-1-yl)propanamide Traditional Name: N-[1-[(4-bromophenoxy)methyl]pyrazol-4-yl]-3-(4-iodo-5-methyl-pyrazol-1-yl)propionamide Formula: C17H17BrIN5O2 MolecularWeight: 530.15765

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=NN1CCC(=O)NC2=CN(N=C2)COC3=CC=C(C=C3)Br)I

Isomeric SMILES

CC1=C(C=NN1CCC(=O)NC2=CN(N=C2)COC3=CC=C(C=C3)Br)I

InChI

InChI=1S/C17H17BrIN5O2/c1-12-16(19)9-21-24(12)7-6-17(25)22-14-8-20-23(10-14)11-26-15-4-2-13(18)3-5-15/h2-5,8-10H,6-7,11H2,1H3,(H,22,25)