3-(1-adamantyl)-1-[[1-[(4-fluorophenyl)methyl]pyrrol-2-yl]methyl]-1-prop-2-enyl-urea

Systemtic Name: 3-(1-adamantyl)-1-[[1-[(4-fluorophenyl)methyl]pyrrol-2-yl]methyl]-1-prop-2-enyl-urea Openeye Name: 3-(1-adamantyl)-1-allyl-1-[[1-[(4-fluorophenyl)methyl]pyrrol-2-yl]methyl]urea CAS Name: 3-(1-adamantyl)-1-[[1-[(4-fluorophenyl)methyl]-2-pyrrolyl]methyl]-1-prop-2-enylurea IUPAC Name: 3-(1-adamantyl)-1-[[1-[(4-fluorophenyl)methyl]pyrrol-2-yl]methyl]-1-prop-2-enylurea Traditional Name: 3-(1-adamantyl)-1-allyl-1-[[1-(4-fluorobenzyl)pyrrol-2-yl]methyl]urea Formula: C26H32FN3O MolecularWeight: 421.550183

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Descriptors Computed from Structure

Canonical SMILES:

C=CCN(CC1=CC=CN1CC2=CC=C(C=C2)F)C(=O)NC34CC5CC(C3)CC(C5)C4

Isomeric SMILES

C=CCN(CC1=CC=CN1CC2=CC=C(C=C2)F)C(=O)NC34CC5CC(C3)CC(C5)C4

InChI

InChI=1S/C26H32FN3O/c1-2-9-30(18-24-4-3-10-29(24)17-19-5-7-23(27)8-6-19)25(31)28-26-14-20-11-21(15-26)13-22(12-20)16-26/h2-8,10,20-22H,1,9,11-18H2,(H,28,31)