N-[(1S)-1-(2-bromophenyl)ethyl]-1-methyl-pyrazole-4-carboxamide

Systemtic Name: N-[(1S)-1-(2-bromophenyl)ethyl]-1-methyl-pyrazole-4-carboxamide Openeye Name: N-[(1S)-1-(2-bromophenyl)ethyl]-1-methyl-pyrazole-4-carboxamide CAS Name: N-[(1S)-1-(2-bromophenyl)ethyl]-1-methyl-4-pyrazolecarboxamide IUPAC Name: N-[(1S)-1-(2-bromophenyl)ethyl]-1-methylpyrazole-4-carboxamide Traditional Name: N-[(1S)-1-(2-bromophenyl)ethyl]-1-methyl-pyrazole-4-carboxamide Formula: C13H14BrN3O MolecularWeight: 308.17376

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Descriptors Computed from Structure

Canonical SMILES:

CC(C1=CC=CC=C1Br)NC(=O)C2=CN(N=C2)C

Isomeric SMILES

C[C@@H](C1=CC=CC=C1Br)NC(=O)C2=CN(N=C2)C

InChI

InChI=1S/C13H14BrN3O/c1-9(11-5-3-4-6-12(11)14)16-13(18)10-7-15-17(2)8-10/h3-9H,1-2H3,(H,16,18)/t9-/m0/s1