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

Systemtic Name: (phenylmethyl) 2-[5-chloranyl-2-oxidanylidene-3-(phenethylamino)-6-phenyl-pyrazin-1-yl]ethanoate Openeye Name: benzyl 2-[5-chloro-2-oxo-3-(phenethylamino)-6-phenyl-pyrazin-1-yl]acetate CAS Name: 2-[5-chloro-2-oxo-3-(phenethylamino)-6-phenyl-1-pyrazinyl]acetic acid (phenylmethyl) ester IUPAC Name: benzyl 2-[5-chloro-2-oxo-3-(phenethylamino)-6-phenylpyrazin-1-yl]acetate Traditional Name: 2-[5-chloro-2-keto-3-(phenethylamino)-6-phenyl-pyrazin-1-yl]acetic acid benzyl ester Formula: C27H24ClN3O3 MolecularWeight: 473.95076

Click to see the large picture

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=C4)Cl

Isomeric SMILES

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

InChI

InChI=1S/C27H24ClN3O3/c28-25-24(22-14-8-3-9-15-22)31(18-23(32)34-19-21-12-6-2-7-13-21)27(33)26(30-25)29-17-16-20-10-4-1-5-11-20/h1-15H,16-19H2,(H,29,30)