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

Systemtic Name: 1-[4-[(4-fluorophenyl)methyl]-2-methyl-3-oxidanylidene-5H-1,4-benzoxazepin-7-yl]-3-(3-methoxyphenyl)urea Openeye Name: 1-[4-[(4-fluorophenyl)methyl]-2-methyl-3-oxo-5H-1,4-benzoxazepin-7-yl]-3-(3-methoxyphenyl)urea CAS Name: 1-[4-[(4-fluorophenyl)methyl]-2-methyl-3-oxo-5H-1,4-benzoxazepin-7-yl]-3-(3-methoxyphenyl)urea IUPAC Name: 1-[4-[(4-fluorophenyl)methyl]-2-methyl-3-oxo-5H-1,4-benzoxazepin-7-yl]-3-(3-methoxyphenyl)urea Traditional Name: 1-[4-(4-fluorobenzyl)-3-keto-2-methyl-5H-1,4-benzoxazepin-7-yl]-3-(3-methoxyphenyl)urea Formula: C25H24FN3O4 MolecularWeight: 449.474163

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Descriptors Computed from Structure

Canonical SMILES:

CC1C(=O)N(CC2=C(O1)C=CC(=C2)NC(=O)NC3=CC(=CC=C3)OC)CC4=CC=C(C=C4)F

Isomeric SMILES

CC1C(=O)N(CC2=C(O1)C=CC(=C2)NC(=O)NC3=CC(=CC=C3)OC)CC4=CC=C(C=C4)F

InChI

InChI=1S/C25H24FN3O4/c1-16-24(30)29(14-17-6-8-19(26)9-7-17)15-18-12-21(10-11-23(18)33-16)28-25(31)27-20-4-3-5-22(13-20)32-2/h3-13,16H,14-15H2,1-2H3,(H2,27,28,31)