3-bromanyl-N-[2-[(2,5-diphenylpyrazol-3-yl)amino]-2-oxidanylidene-ethyl]-N-pentyl-benzamide

Systemtic Name: 3-bromanyl-N-[2-[(2,5-diphenylpyrazol-3-yl)amino]-2-oxidanylidene-ethyl]-N-pentyl-benzamide Openeye Name: 3-bromo-N-[2-[(2,5-diphenylpyrazol-3-yl)amino]-2-oxo-ethyl]-N-pentyl-benzamide CAS Name: 3-bromo-N-[2-[(2,5-diphenyl-3-pyrazolyl)amino]-2-oxoethyl]-N-pentylbenzamide IUPAC Name: 3-bromo-N-[2-[(2,5-diphenylpyrazol-3-yl)amino]-2-oxoethyl]-N-pentylbenzamide Traditional Name: N-amyl-3-bromo-N-[2-[(2,5-diphenylpyrazol-3-yl)amino]-2-keto-ethyl]benzamide Formula: C29H29BrN4O2 MolecularWeight: 545.47016

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCN(CC(=O)NC1=CC(=NN1C2=CC=CC=C2)C3=CC=CC=C3)C(=O)C4=CC(=CC=C4)Br

Isomeric SMILES

CCCCCN(CC(=O)NC1=CC(=NN1C2=CC=CC=C2)C3=CC=CC=C3)C(=O)C4=CC(=CC=C4)Br

InChI

InChI=1S/C29H29BrN4O2/c1-2-3-10-18-33(29(36)23-14-11-15-24(30)19-23)21-28(35)31-27-20-26(22-12-6-4-7-13-22)32-34(27)25-16-8-5-9-17-25/h4-9,11-17,19-20H,2-3,10,18,21H2,1H3,(H,31,35)