1-[4-[(E)-3-bromanylprop-1-enyl]naphthalen-1-yl]-3-[5-tert-butyl-2-(4-methylphenyl)pyrazol-3-yl]urea

Systemtic Name: 1-[4-[(E)-3-bromanylprop-1-enyl]naphthalen-1-yl]-3-[5-tert-butyl-2-(4-methylphenyl)pyrazol-3-yl]urea Openeye Name: 1-[4-[(E)-3-bromoprop-1-enyl]-1-naphthyl]-3-[5-tert-butyl-2-(p-tolyl)pyrazol-3-yl]urea CAS Name: 1-[4-[(E)-3-bromoprop-1-enyl]-1-naphthalenyl]-3-[5-tert-butyl-2-(4-methylphenyl)-3-pyrazolyl]urea IUPAC Name: 1-[4-[(E)-3-bromoprop-1-enyl]naphthalen-1-yl]-3-[5-tert-butyl-2-(4-methylphenyl)pyrazol-3-yl]urea Traditional Name: 1-[4-[(E)-3-bromoprop-1-enyl]-1-naphthyl]-3-[5-tert-butyl-2-(p-tolyl)pyrazol-3-yl]urea Formula: C28H29BrN4O MolecularWeight: 517.46006

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)N2C(=CC(=N2)C(C)(C)C)NC(=O)NC3=CC=C(C4=CC=CC=C43)C=CCBr

Isomeric SMILES

CC1=CC=C(C=C1)N2C(=CC(=N2)C(C)(C)C)NC(=O)NC3=CC=C(C4=CC=CC=C43)/C=C/CBr

InChI

InChI=1S/C28H29BrN4O/c1-19-11-14-21(15-12-19)33-26(18-25(32-33)28(2,3)4)31-27(34)30-24-16-13-20(8-7-17-29)22-9-5-6-10-23(22)24/h5-16,18H,17H2,1-4H3,(H2,30,31,34)/b8-7+