1-[(4-bromanylphenoxy)methyl]-N-[3-(dimethylamino)propyl]pyrazole-3-carboxamide

Systemtic Name: 1-[(4-bromanylphenoxy)methyl]-N-[3-(dimethylamino)propyl]pyrazole-3-carboxamide Openeye Name: 1-[(4-bromophenoxy)methyl]-N-[3-(dimethylamino)propyl]pyrazole-3-carboxamide CAS Name: 1-[(4-bromophenoxy)methyl]-N-[3-(dimethylamino)propyl]-3-pyrazolecarboxamide IUPAC Name: 1-[(4-bromophenoxy)methyl]-N-[3-(dimethylamino)propyl]pyrazole-3-carboxamide Traditional Name: 1-[(4-bromophenoxy)methyl]-N-[3-(dimethylamino)propyl]pyrazole-3-carboxamide Formula: C16H21BrN4O2 MolecularWeight: 381.26754

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Descriptors Computed from Structure

Canonical SMILES:

CN(C)CCCNC(=O)C1=NN(C=C1)COC2=CC=C(C=C2)Br

Isomeric SMILES

CN(C)CCCNC(=O)C1=NN(C=C1)COC2=CC=C(C=C2)Br

InChI

InChI=1S/C16H21BrN4O2/c1-20(2)10-3-9-18-16(22)15-8-11-21(19-15)12-23-14-6-4-13(17)5-7-14/h4-8,11H,3,9-10,12H2,1-2H3,(H,18,22)