2-(4-bromanylpyrazol-1-yl)-N-[(1,3-diphenylpyrazol-4-yl)methyl]butanamide

Systemtic Name: 2-(4-bromanylpyrazol-1-yl)-N-[(1,3-diphenylpyrazol-4-yl)methyl]butanamide Openeye Name: 2-(4-bromopyrazol-1-yl)-N-[(1,3-diphenylpyrazol-4-yl)methyl]butanamide CAS Name: 2-(4-bromo-1-pyrazolyl)-N-[(1,3-diphenyl-4-pyrazolyl)methyl]butanamide IUPAC Name: 2-(4-bromopyrazol-1-yl)-N-[(1,3-diphenylpyrazol-4-yl)methyl]butanamide Traditional Name: 2-(4-bromopyrazol-1-yl)-N-[(1,3-diphenylpyrazol-4-yl)methyl]butyramide Formula: C23H22BrN5O MolecularWeight: 464.35768

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C(=O)NCC1=CN(N=C1C2=CC=CC=C2)C3=CC=CC=C3)N4C=C(C=N4)Br

Isomeric SMILES

CCC(C(=O)NCC1=CN(N=C1C2=CC=CC=C2)C3=CC=CC=C3)N4C=C(C=N4)Br

InChI

InChI=1S/C23H22BrN5O/c1-2-21(29-16-19(24)14-26-29)23(30)25-13-18-15-28(20-11-7-4-8-12-20)27-22(18)17-9-5-3-6-10-17/h3-12,14-16,21H,2,13H2,1H3,(H,25,30)