1-[2,6-di(propan-2-yl)phenyl]-3-(5-dodecyl-2-pyridin-2-yl-pyrazol-3-yl)urea

Systemtic Name: 1-[2,6-di(propan-2-yl)phenyl]-3-(5-dodecyl-2-pyridin-2-yl-pyrazol-3-yl)urea Openeye Name: 1-(2,6-diisopropylphenyl)-3-[5-dodecyl-2-(2-pyridyl)pyrazol-3-yl]urea CAS Name: 1-[2,6-di(propan-2-yl)phenyl]-3-[5-dodecyl-2-(2-pyridinyl)-3-pyrazolyl]urea IUPAC Name: 1-[2,6-di(propan-2-yl)phenyl]-3-(5-dodecyl-2-pyridin-2-ylpyrazol-3-yl)urea Traditional Name: 1-(2,6-diisopropylphenyl)-3-[5-lauryl-2-(2-pyridyl)pyrazol-3-yl]urea Formula: C33H49N5O MolecularWeight: 531.77506

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCC1=NN(C(=C1)NC(=O)NC2=C(C=CC=C2C(C)C)C(C)C)C3=CC=CC=N3

Isomeric SMILES

CCCCCCCCCCCCC1=NN(C(=C1)NC(=O)NC2=C(C=CC=C2C(C)C)C(C)C)C3=CC=CC=N3

InChI

InChI=1S/C33H49N5O/c1-6-7-8-9-10-11-12-13-14-15-19-27-24-31(38(37-27)30-22-16-17-23-34-30)35-33(39)36-32-28(25(2)3)20-18-21-29(32)26(4)5/h16-18,20-26H,6-15,19H2,1-5H3,(H2,35,36,39)