N-[(2S)-1-azanyl-1-oxidanylidene-3-phenyl-propan-2-yl]-4-[3-(3,4-dichlorophenyl)-5-pyridin-3-yl-phenoxy]butanamide

Systemtic Name: N-[(2S)-1-azanyl-1-oxidanylidene-3-phenyl-propan-2-yl]-4-[3-(3,4-dichlorophenyl)-5-pyridin-3-yl-phenoxy]butanamide Openeye Name: N-[(1S)-2-amino-1-benzyl-2-oxo-ethyl]-4-[3-(3,4-dichlorophenyl)-5-(3-pyridyl)phenoxy]butanamide CAS Name: N-[(2S)-1-amino-1-oxo-3-phenylpropan-2-yl]-4-[3-(3,4-dichlorophenyl)-5-(3-pyridinyl)phenoxy]butanamide IUPAC Name: N-[(2S)-1-amino-1-oxo-3-phenylpropan-2-yl]-4-[3-(3,4-dichlorophenyl)-5-pyridin-3-ylphenoxy]butanamide Traditional Name: N-[(1S)-2-amino-1-benzyl-2-keto-ethyl]-4-[3-(3,4-dichlorophenyl)-5-(3-pyridyl)phenoxy]butyramide Formula: C30H27Cl2N3O3 MolecularWeight: 548.45968

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CC(C(=O)N)NC(=O)CCCOC2=CC(=CC(=C2)C3=CN=CC=C3)C4=CC(=C(C=C4)Cl)Cl

Isomeric SMILES

C1=CC=C(C=C1)C[C@@H](C(=O)N)NC(=O)CCCOC2=CC(=CC(=C2)C3=CN=CC=C3)C4=CC(=C(C=C4)Cl)Cl

InChI

InChI=1S/C30H27Cl2N3O3/c31-26-11-10-21(18-27(26)32)23-15-24(22-8-4-12-34-19-22)17-25(16-23)38-13-5-9-29(36)35-28(30(33)37)14-20-6-2-1-3-7-20/h1-4,6-8,10-12,15-19,28H,5,9,13-14H2,(H2,33,37)(H,35,36)/t28-/m0/s1