3-bromanyl-N-[2-[(5-tert-butyl-2-phenyl-pyrazol-3-yl)amino]-2-oxidanylidene-ethyl]-N-(phenylmethyl)benzamide

Systemtic Name: 3-bromanyl-N-[2-[(5-tert-butyl-2-phenyl-pyrazol-3-yl)amino]-2-oxidanylidene-ethyl]-N-(phenylmethyl)benzamide Openeye Name: N-benzyl-3-bromo-N-[2-[(5-tert-butyl-2-phenyl-pyrazol-3-yl)amino]-2-oxo-ethyl]benzamide CAS Name: 3-bromo-N-[2-[(5-tert-butyl-2-phenyl-3-pyrazolyl)amino]-2-oxoethyl]-N-(phenylmethyl)benzamide IUPAC Name: N-benzyl-3-bromo-N-[2-[(5-tert-butyl-2-phenylpyrazol-3-yl)amino]-2-oxoethyl]benzamide Traditional Name: N-benzyl-3-bromo-N-[2-[(5-tert-butyl-2-phenyl-pyrazol-3-yl)amino]-2-keto-ethyl]benzamide Formula: C29H29BrN4O2 MolecularWeight: 545.47016

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=NN(C(=C1)NC(=O)CN(CC2=CC=CC=C2)C(=O)C3=CC(=CC=C3)Br)C4=CC=CC=C4

Isomeric SMILES

CC(C)(C)C1=NN(C(=C1)NC(=O)CN(CC2=CC=CC=C2)C(=O)C3=CC(=CC=C3)Br)C4=CC=CC=C4

InChI

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