1-[(4-bromanylpyrazol-1-yl)methyl]-N-[(1S)-1-(4-pyrrol-1-ylphenyl)ethyl]pyrazole-3-carboxamide

Systemtic Name: 1-[(4-bromanylpyrazol-1-yl)methyl]-N-[(1S)-1-(4-pyrrol-1-ylphenyl)ethyl]pyrazole-3-carboxamide Openeye Name: 1-[(4-bromopyrazol-1-yl)methyl]-N-[(1S)-1-(4-pyrrol-1-ylphenyl)ethyl]pyrazole-3-carboxamide CAS Name: 1-[(4-bromo-1-pyrazolyl)methyl]-N-[(1S)-1-[4-(1-pyrrolyl)phenyl]ethyl]-3-pyrazolecarboxamide IUPAC Name: 1-[(4-bromopyrazol-1-yl)methyl]-N-[(1S)-1-(4-pyrrol-1-ylphenyl)ethyl]pyrazole-3-carboxamide Traditional Name: 1-[(4-bromopyrazol-1-yl)methyl]-N-[(1S)-1-(4-pyrrol-1-ylphenyl)ethyl]pyrazole-3-carboxamide Formula: C20H19BrN6O MolecularWeight: 439.30846

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Descriptors Computed from Structure

Canonical SMILES:

CC(C1=CC=C(C=C1)N2C=CC=C2)NC(=O)C3=NN(C=C3)CN4C=C(C=N4)Br

Isomeric SMILES

C[C@@H](C1=CC=C(C=C1)N2C=CC=C2)NC(=O)C3=NN(C=C3)CN4C=C(C=N4)Br

InChI

InChI=1S/C20H19BrN6O/c1-15(16-4-6-18(7-5-16)25-9-2-3-10-25)23-20(28)19-8-11-26(24-19)14-27-13-17(21)12-22-27/h2-13,15H,14H2,1H3,(H,23,28)/t15-/m0/s1