3-(4-bromophenyl)-N-[2-(2-methylpropanoylamino)ethyl]-1H-pyrazole-5-carboxamide

Systemtic Name: 3-(4-bromophenyl)-N-[2-(2-methylpropanoylamino)ethyl]-1H-pyrazole-5-carboxamide Openeye Name: 3-(4-bromophenyl)-N-[2-(2-methylpropanoylamino)ethyl]-1H-pyrazole-5-carboxamide CAS Name: 3-(4-bromophenyl)-N-[2-[(2-methyl-1-oxopropyl)amino]ethyl]-1H-pyrazole-5-carboxamide IUPAC Name: 3-(4-bromophenyl)-N-[2-(2-methylpropanoylamino)ethyl]-1H-pyrazole-5-carboxamide Traditional Name: 3-(4-bromophenyl)-N-[2-(isobutyrylamino)ethyl]-1H-pyrazole-5-carboxamide Formula: C16H19BrN4O2 MolecularWeight: 379.25166

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C(=O)NCCNC(=O)C1=CC(=NN1)C2=CC=C(C=C2)Br

Isomeric SMILES

CC(C)C(=O)NCCNC(=O)C1=CC(=NN1)C2=CC=C(C=C2)Br

InChI

InChI=1S/C16H19BrN4O2/c1-10(2)15(22)18-7-8-19-16(23)14-9-13(20-21-14)11-3-5-12(17)6-4-11/h3-6,9-10H,7-8H2,1-2H3,(H,18,22)(H,19,23)(H,20,21)