1-ethyl-3-[4-[(4-fluorophenyl)methyl]-2-methyl-3-oxidanylidene-5H-1,4-benzoxazepin-7-yl]urea

Systemtic Name: 1-ethyl-3-[4-[(4-fluorophenyl)methyl]-2-methyl-3-oxidanylidene-5H-1,4-benzoxazepin-7-yl]urea Openeye Name: 1-ethyl-3-[4-[(4-fluorophenyl)methyl]-2-methyl-3-oxo-5H-1,4-benzoxazepin-7-yl]urea CAS Name: 1-ethyl-3-[4-[(4-fluorophenyl)methyl]-2-methyl-3-oxo-5H-1,4-benzoxazepin-7-yl]urea IUPAC Name: 1-ethyl-3-[4-[(4-fluorophenyl)methyl]-2-methyl-3-oxo-5H-1,4-benzoxazepin-7-yl]urea Traditional Name: 1-ethyl-3-[4-(4-fluorobenzyl)-3-keto-2-methyl-5H-1,4-benzoxazepin-7-yl]urea Formula: C20H22FN3O3 MolecularWeight: 371.405383

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Descriptors Computed from Structure

Canonical SMILES:

CCNC(=O)NC1=CC2=C(C=C1)OC(C(=O)N(C2)CC3=CC=C(C=C3)F)C

Isomeric SMILES

CCNC(=O)NC1=CC2=C(C=C1)OC(C(=O)N(C2)CC3=CC=C(C=C3)F)C

InChI

InChI=1S/C20H22FN3O3/c1-3-22-20(26)23-17-8-9-18-15(10-17)12-24(19(25)13(2)27-18)11-14-4-6-16(21)7-5-14/h4-10,13H,3,11-12H2,1-2H3,(H2,22,23,26)