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

Systemtic Name: 1-cycloheptyl-1-[(4-phenylthiophen-2-yl)methyl]-3-(2,4,6-trimethylphenyl)urea Openeye Name: 1-cycloheptyl-1-[(4-phenyl-2-thienyl)methyl]-3-(2,4,6-trimethylphenyl)urea CAS Name: 1-cycloheptyl-1-[(4-phenyl-2-thiophenyl)methyl]-3-(2,4,6-trimethylphenyl)urea IUPAC Name: 1-cycloheptyl-1-[(4-phenylthiophen-2-yl)methyl]-3-(2,4,6-trimethylphenyl)urea Traditional Name: 1-cycloheptyl-3-mesityl-1-[(4-phenyl-2-thienyl)methyl]urea Formula: C28H34N2OS MolecularWeight: 446.64736

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C(=C1)C)NC(=O)N(CC2=CC(=CS2)C3=CC=CC=C3)C4CCCCCC4)C

Isomeric SMILES

CC1=CC(=C(C(=C1)C)NC(=O)N(CC2=CC(=CS2)C3=CC=CC=C3)C4CCCCCC4)C

InChI

InChI=1S/C28H34N2OS/c1-20-15-21(2)27(22(3)16-20)29-28(31)30(25-13-9-4-5-10-14-25)18-26-17-24(19-32-26)23-11-7-6-8-12-23/h6-8,11-12,15-17,19,25H,4-5,9-10,13-14,18H2,1-3H3,(H,29,31)