4-[(3R)-3-azanyl-4-[2,4,5-tris(fluoranyl)phenyl]butanoyl]-3-[[2,3-bis(fluoranyl)phenyl]methyl]-1,4-diazepan-2-one

Systemtic Name: 4-[(3R)-3-azanyl-4-[2,4,5-tris(fluoranyl)phenyl]butanoyl]-3-[[2,3-bis(fluoranyl)phenyl]methyl]-1,4-diazepan-2-one Openeye Name: 4-[(3R)-3-amino-4-(2,4,5-trifluorophenyl)butanoyl]-3-[(2,3-difluorophenyl)methyl]-1,4-diazepan-2-one CAS Name: 4-[(3R)-3-amino-1-oxo-4-(2,4,5-trifluorophenyl)butyl]-3-[(2,3-difluorophenyl)methyl]-1,4-diazepan-2-one IUPAC Name: 4-[(3R)-3-amino-4-(2,4,5-trifluorophenyl)butanoyl]-3-[(2,3-difluorophenyl)methyl]-1,4-diazepan-2-one Traditional Name: 4-[(3R)-3-amino-4-(2,4,5-trifluorophenyl)butanoyl]-3-(2,3-difluorobenzyl)-1,4-diazepan-2-one Formula: C22H22F5N3O2 MolecularWeight: 455.420996

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Descriptors Computed from Structure

Canonical SMILES:

C1CNC(=O)C(N(C1)C(=O)CC(CC2=CC(=C(C=C2F)F)F)N)CC3=C(C(=CC=C3)F)F

Isomeric SMILES

C1CNC(=O)C(N(C1)C(=O)C[C@@H](CC2=CC(=C(C=C2F)F)F)N)CC3=C(C(=CC=C3)F)F

InChI

InChI=1S/C22H22F5N3O2/c23-15-4-1-3-12(21(15)27)9-19-22(32)29-5-2-6-30(19)20(31)10-14(28)7-13-8-17(25)18(26)11-16(13)24/h1,3-4,8,11,14,19H,2,5-7,9-10,28H2,(H,29,32)/t14-,19?/m1/s1