1-ethyl-3-[[3-[4-(2-methyl-7-morpholin-4-yl-heptan-2-yl)-2-oxidanyl-phenyl]phenyl]methyl]urea

Systemtic Name: 1-ethyl-3-[[3-[4-(2-methyl-7-morpholin-4-yl-heptan-2-yl)-2-oxidanyl-phenyl]phenyl]methyl]urea Openeye Name: 1-[[3-[4-(1,1-dimethyl-6-morpholino-hexyl)-2-hydroxy-phenyl]phenyl]methyl]-3-ethyl-urea CAS Name: 1-ethyl-3-[[3-[2-hydroxy-4-[2-methyl-7-(4-morpholinyl)heptan-2-yl]phenyl]phenyl]methyl]urea IUPAC Name: 1-ethyl-3-[[3-[2-hydroxy-4-(2-methyl-7-morpholin-4-ylheptan-2-yl)phenyl]phenyl]methyl]urea Traditional Name: 1-[3-[4-(1,1-dimethyl-6-morpholino-hexyl)-2-hydroxy-phenyl]benzyl]-3-ethyl-urea Formula: C28H41N3O3 MolecularWeight: 467.64344

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Descriptors Computed from Structure

Canonical SMILES:

CCNC(=O)NCC1=CC=CC(=C1)C2=C(C=C(C=C2)C(C)(C)CCCCCN3CCOCC3)O

Isomeric SMILES

CCNC(=O)NCC1=CC=CC(=C1)C2=C(C=C(C=C2)C(C)(C)CCCCCN3CCOCC3)O

InChI

InChI=1S/C28H41N3O3/c1-4-29-27(33)30-21-22-9-8-10-23(19-22)25-12-11-24(20-26(25)32)28(2,3)13-6-5-7-14-31-15-17-34-18-16-31/h8-12,19-20,32H,4-7,13-18,21H2,1-3H3,(H2,29,30,33)