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

Systemtic Name: 1-cycloheptyl-1-[(4-pyridin-3-ylphenyl)methyl]-3-(2,4,6-trimethylphenyl)urea Openeye Name: 1-cycloheptyl-1-[[4-(3-pyridyl)phenyl]methyl]-3-(2,4,6-trimethylphenyl)urea CAS Name: 1-cycloheptyl-1-[[4-(3-pyridinyl)phenyl]methyl]-3-(2,4,6-trimethylphenyl)urea IUPAC Name: 1-cycloheptyl-1-[(4-pyridin-3-ylphenyl)methyl]-3-(2,4,6-trimethylphenyl)urea Traditional Name: 1-cycloheptyl-3-mesityl-1-[4-(3-pyridyl)benzyl]urea Formula: C29H35N3O MolecularWeight: 441.6077

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C29H35N3O/c1-21-17-22(2)28(23(3)18-21)31-29(33)32(27-10-6-4-5-7-11-27)20-24-12-14-25(15-13-24)26-9-8-16-30-19-26/h8-9,12-19,27H,4-7,10-11,20H2,1-3H3,(H,31,33)