1-[(4-bromanylphenoxy)methyl]-N-[1-(dipentylamino)propan-2-yl]pyrazole-3-carboxamide

Systemtic Name: 1-[(4-bromanylphenoxy)methyl]-N-[1-(dipentylamino)propan-2-yl]pyrazole-3-carboxamide Openeye Name: 1-[(4-bromophenoxy)methyl]-N-[2-(dipentylamino)-1-methyl-ethyl]pyrazole-3-carboxamide CAS Name: 1-[(4-bromophenoxy)methyl]-N-[1-(dipentylamino)propan-2-yl]-3-pyrazolecarboxamide IUPAC Name: 1-[(4-bromophenoxy)methyl]-N-[1-(dipentylamino)propan-2-yl]pyrazole-3-carboxamide Traditional Name: 1-[(4-bromophenoxy)methyl]-N-[2-(diamylamino)-1-methyl-ethyl]pyrazole-3-carboxamide Formula: C24H37BrN4O2 MolecularWeight: 493.48018

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCN(CCCCC)CC(C)NC(=O)C1=NN(C=C1)COC2=CC=C(C=C2)Br

Isomeric SMILES

CCCCCN(CCCCC)CC(C)NC(=O)C1=NN(C=C1)COC2=CC=C(C=C2)Br

InChI

InChI=1S/C24H37BrN4O2/c1-4-6-8-15-28(16-9-7-5-2)18-20(3)26-24(30)23-14-17-29(27-23)19-31-22-12-10-21(25)11-13-22/h10-14,17,20H,4-9,15-16,18-19H2,1-3H3,(H,26,30)