(phenylmethyl) 2-[3-chloranyl-2-(2-fluorophenyl)-6-oxidanylidene-5-(phenethylamino)pyrazin-1-yl]ethanoate

Systemtic Name: (phenylmethyl) 2-[3-chloranyl-2-(2-fluorophenyl)-6-oxidanylidene-5-(phenethylamino)pyrazin-1-yl]ethanoate Openeye Name: benzyl 2-[3-chloro-2-(2-fluorophenyl)-6-oxo-5-(phenethylamino)pyrazin-1-yl]acetate CAS Name: 2-[3-chloro-2-(2-fluorophenyl)-6-oxo-5-(phenethylamino)-1-pyrazinyl]acetic acid (phenylmethyl) ester IUPAC Name: benzyl 2-[3-chloro-2-(2-fluorophenyl)-6-oxo-5-(phenethylamino)pyrazin-1-yl]acetate Traditional Name: 2-[3-chloro-2-(2-fluorophenyl)-6-keto-5-(phenethylamino)pyrazin-1-yl]acetic acid benzyl ester Formula: C27H23ClFN3O3 MolecularWeight: 491.941223

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CCNC2=NC(=C(N(C2=O)CC(=O)OCC3=CC=CC=C3)C4=CC=CC=C4F)Cl

Isomeric SMILES

C1=CC=C(C=C1)CCNC2=NC(=C(N(C2=O)CC(=O)OCC3=CC=CC=C3)C4=CC=CC=C4F)Cl

InChI

InChI=1S/C27H23ClFN3O3/c28-25-24(21-13-7-8-14-22(21)29)32(17-23(33)35-18-20-11-5-2-6-12-20)27(34)26(31-25)30-16-15-19-9-3-1-4-10-19/h1-14H,15-18H2,(H,30,31)