3-(1-adamantyl)-1-(4-methoxyphenyl)-1-[(E)-2-methyl-3-phenyl-prop-2-enyl]urea

Systemtic Name: 3-(1-adamantyl)-1-(4-methoxyphenyl)-1-[(E)-2-methyl-3-phenyl-prop-2-enyl]urea Openeye Name: 3-(1-adamantyl)-1-(4-methoxyphenyl)-1-[(E)-2-methyl-3-phenyl-allyl]urea CAS Name: 3-(1-adamantyl)-1-(4-methoxyphenyl)-1-[(E)-2-methyl-3-phenylprop-2-enyl]urea IUPAC Name: 3-(1-adamantyl)-1-(4-methoxyphenyl)-1-[(E)-2-methyl-3-phenylprop-2-enyl]urea Traditional Name: 3-(1-adamantyl)-1-(4-methoxyphenyl)-1-[(E)-2-methyl-3-phenyl-allyl]urea Formula: C28H34N2O2 MolecularWeight: 430.58176

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Descriptors Computed from Structure

Canonical SMILES:

CC(=CC1=CC=CC=C1)CN(C2=CC=C(C=C2)OC)C(=O)NC34CC5CC(C3)CC(C5)C4

Isomeric SMILES

C/C(=C\C1=CC=CC=C1)/CN(C2=CC=C(C=C2)OC)C(=O)NC34CC5CC(C3)CC(C5)C4

InChI

InChI=1S/C28H34N2O2/c1-20(12-21-6-4-3-5-7-21)19-30(25-8-10-26(32-2)11-9-25)27(31)29-28-16-22-13-23(17-28)15-24(14-22)18-28/h3-12,22-24H,13-19H2,1-2H3,(H,29,31)/b20-12+