ethyl 5-[2-(3-bromophenyl)ethanoylamino]-3-ethyl-1-methyl-pyrazole-4-carboxylate

Systemtic Name: ethyl 5-[2-(3-bromophenyl)ethanoylamino]-3-ethyl-1-methyl-pyrazole-4-carboxylate Openeye Name: ethyl 5-[[2-(3-bromophenyl)acetyl]amino]-3-ethyl-1-methyl-pyrazole-4-carboxylate CAS Name: 5-[[2-(3-bromophenyl)-1-oxoethyl]amino]-3-ethyl-1-methyl-4-pyrazolecarboxylic acid ethyl ester IUPAC Name: ethyl 5-[[2-(3-bromophenyl)acetyl]amino]-3-ethyl-1-methylpyrazole-4-carboxylate Traditional Name: 5-[[2-(3-bromophenyl)acetyl]amino]-3-ethyl-1-methyl-pyrazole-4-carboxylic acid ethyl ester Formula: C17H20BrN3O3 MolecularWeight: 394.263

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=NN(C(=C1C(=O)OCC)NC(=O)CC2=CC(=CC=C2)Br)C

Isomeric SMILES

CCC1=NN(C(=C1C(=O)OCC)NC(=O)CC2=CC(=CC=C2)Br)C

InChI

InChI=1S/C17H20BrN3O3/c1-4-13-15(17(23)24-5-2)16(21(3)20-13)19-14(22)10-11-7-6-8-12(18)9-11/h6-9H,4-5,10H2,1-3H3,(H,19,22)