1-cycloheptyl-1-[(4-pyrazol-1-ylphenyl)methyl]-3-(2,4,6-trimethylphenyl)urea

Systemtic Name: 1-cycloheptyl-1-[(4-pyrazol-1-ylphenyl)methyl]-3-(2,4,6-trimethylphenyl)urea Openeye Name: 1-cycloheptyl-1-[(4-pyrazol-1-ylphenyl)methyl]-3-(2,4,6-trimethylphenyl)urea CAS Name: 1-cycloheptyl-1-[[4-(1-pyrazolyl)phenyl]methyl]-3-(2,4,6-trimethylphenyl)urea IUPAC Name: 1-cycloheptyl-1-[(4-pyrazol-1-ylphenyl)methyl]-3-(2,4,6-trimethylphenyl)urea Traditional Name: 1-cycloheptyl-3-mesityl-1-(4-pyrazol-1-ylbenzyl)urea Formula: C27H34N4O MolecularWeight: 430.58506

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C(=C1)C)NC(=O)N(CC2=CC=C(C=C2)N3C=CC=N3)C4CCCCCC4)C

Isomeric SMILES

CC1=CC(=C(C(=C1)C)NC(=O)N(CC2=CC=C(C=C2)N3C=CC=N3)C4CCCCCC4)C

InChI

InChI=1S/C27H34N4O/c1-20-17-21(2)26(22(3)18-20)29-27(32)30(24-9-6-4-5-7-10-24)19-23-11-13-25(14-12-23)31-16-8-15-28-31/h8,11-18,24H,4-7,9-10,19H2,1-3H3,(H,29,32)