2-[3-[[3,5-bis(fluoranyl)phenyl]methylamino]-5-chloranyl-2-oxidanylidene-6-phenyl-pyrazin-1-yl]ethanoic acid

Systemtic Name: 2-[3-[[3,5-bis(fluoranyl)phenyl]methylamino]-5-chloranyl-2-oxidanylidene-6-phenyl-pyrazin-1-yl]ethanoic acid Openeye Name: 2-[5-chloro-3-[(3,5-difluorophenyl)methylamino]-2-oxo-6-phenyl-pyrazin-1-yl]acetic acid CAS Name: 2-[5-chloro-3-[(3,5-difluorophenyl)methylamino]-2-oxo-6-phenyl-1-pyrazinyl]acetic acid IUPAC Name: 2-[5-chloro-3-[(3,5-difluorophenyl)methylamino]-2-oxo-6-phenylpyrazin-1-yl]acetic acid Traditional Name: 2-[5-chloro-3-[(3,5-difluorobenzyl)amino]-2-keto-6-phenyl-pyrazin-1-yl]acetic acid Formula: C19H14ClF2N3O3 MolecularWeight: 405.782566

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C2=C(N=C(C(=O)N2CC(=O)O)NCC3=CC(=CC(=C3)F)F)Cl

Isomeric SMILES

C1=CC=C(C=C1)C2=C(N=C(C(=O)N2CC(=O)O)NCC3=CC(=CC(=C3)F)F)Cl

InChI

InChI=1S/C19H14ClF2N3O3/c20-17-16(12-4-2-1-3-5-12)25(10-15(26)27)19(28)18(24-17)23-9-11-6-13(21)8-14(22)7-11/h1-8H,9-10H2,(H,23,24)(H,26,27)