1-[2,6-di(propan-2-yl)phenyl]-3-(2-undecylpyrazol-3-yl)urea

Systemtic Name: 1-[2,6-di(propan-2-yl)phenyl]-3-(2-undecylpyrazol-3-yl)urea Openeye Name: 1-(2,6-diisopropylphenyl)-3-(2-undecylpyrazol-3-yl)urea CAS Name: 1-[2,6-di(propan-2-yl)phenyl]-3-(2-undecyl-3-pyrazolyl)urea IUPAC Name: 1-[2,6-di(propan-2-yl)phenyl]-3-(2-undecylpyrazol-3-yl)urea Traditional Name: 1-(2,6-diisopropylphenyl)-3-(2-undecylpyrazol-3-yl)urea Formula: C27H44N4O MolecularWeight: 440.66446

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCN1C(=CC=N1)NC(=O)NC2=C(C=CC=C2C(C)C)C(C)C

Isomeric SMILES

CCCCCCCCCCCN1C(=CC=N1)NC(=O)NC2=C(C=CC=C2C(C)C)C(C)C

InChI

InChI=1S/C27H44N4O/c1-6-7-8-9-10-11-12-13-14-20-31-25(18-19-28-31)29-27(32)30-26-23(21(2)3)16-15-17-24(26)22(4)5/h15-19,21-22H,6-14,20H2,1-5H3,(H2,29,30,32)