1-cycloheptyl-1-[(5-phenyl-1,2-oxazol-3-yl)methyl]-3-(2,4,6-trimethylphenyl)urea

Systemtic Name: 1-cycloheptyl-1-[(5-phenyl-1,2-oxazol-3-yl)methyl]-3-(2,4,6-trimethylphenyl)urea Openeye Name: 1-cycloheptyl-1-[(5-phenylisoxazol-3-yl)methyl]-3-(2,4,6-trimethylphenyl)urea CAS Name: 1-cycloheptyl-1-[(5-phenyl-3-isoxazolyl)methyl]-3-(2,4,6-trimethylphenyl)urea IUPAC Name: 1-cycloheptyl-1-[(5-phenyl-1,2-oxazol-3-yl)methyl]-3-(2,4,6-trimethylphenyl)urea Traditional Name: 1-cycloheptyl-3-mesityl-1-[(5-phenylisoxazol-3-yl)methyl]urea Formula: C27H33N3O2 MolecularWeight: 431.56982

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C(=C1)C)NC(=O)N(CC2=NOC(=C2)C3=CC=CC=C3)C4CCCCCC4)C

Isomeric SMILES

CC1=CC(=C(C(=C1)C)NC(=O)N(CC2=NOC(=C2)C3=CC=CC=C3)C4CCCCCC4)C

InChI

InChI=1S/C27H33N3O2/c1-19-15-20(2)26(21(3)16-19)28-27(31)30(24-13-9-4-5-10-14-24)18-23-17-25(32-29-23)22-11-7-6-8-12-22/h6-8,11-12,15-17,24H,4-5,9-10,13-14,18H2,1-3H3,(H,28,31)