1-[2-(1-adamantylcarbamoylamino)ethyl]-1-(4-fluorophenyl)-3-(4-methoxyphenyl)urea

Systemtic Name: 1-[2-(1-adamantylcarbamoylamino)ethyl]-1-(4-fluorophenyl)-3-(4-methoxyphenyl)urea Openeye Name: 1-[2-(1-adamantylcarbamoylamino)ethyl]-1-(4-fluorophenyl)-3-(4-methoxyphenyl)urea CAS Name: 1-[2-[[(1-adamantylamino)-oxomethyl]amino]ethyl]-1-(4-fluorophenyl)-3-(4-methoxyphenyl)urea IUPAC Name: 1-[2-(1-adamantylcarbamoylamino)ethyl]-1-(4-fluorophenyl)-3-(4-methoxyphenyl)urea Traditional Name: 1-[2-(1-adamantylcarbamoylamino)ethyl]-1-(4-fluorophenyl)-3-(4-methoxyphenyl)urea Formula: C27H33FN4O3 MolecularWeight: 480.574323

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)NC(=O)N(CCNC(=O)NC23CC4CC(C2)CC(C4)C3)C5=CC=C(C=C5)F

Isomeric SMILES

COC1=CC=C(C=C1)NC(=O)N(CCNC(=O)NC23CC4CC(C2)CC(C4)C3)C5=CC=C(C=C5)F

InChI

InChI=1S/C27H33FN4O3/c1-35-24-8-4-22(5-9-24)30-26(34)32(23-6-2-21(28)3-7-23)11-10-29-25(33)31-27-15-18-12-19(16-27)14-20(13-18)17-27/h2-9,18-20H,10-17H2,1H3,(H,30,34)(H2,29,31,33)