(phenylmethyl) 2-[3-chloranyl-2-methyl-6-oxidanylidene-5-[(1-phenylcyclobutyl)methylamino]pyrazin-1-yl]ethanoate

Systemtic Name: (phenylmethyl) 2-[3-chloranyl-2-methyl-6-oxidanylidene-5-[(1-phenylcyclobutyl)methylamino]pyrazin-1-yl]ethanoate Openeye Name: benzyl 2-[3-chloro-2-methyl-6-oxo-5-[(1-phenylcyclobutyl)methylamino]pyrazin-1-yl]acetate CAS Name: 2-[3-chloro-2-methyl-6-oxo-5-[(1-phenylcyclobutyl)methylamino]-1-pyrazinyl]acetic acid (phenylmethyl) ester IUPAC Name: benzyl 2-[3-chloro-2-methyl-6-oxo-5-[(1-phenylcyclobutyl)methylamino]pyrazin-1-yl]acetate Traditional Name: 2-[5-chloro-2-keto-6-methyl-3-[(1-phenylcyclobutyl)methylamino]pyrazin-1-yl]acetic acid benzyl ester Formula: C25H26ClN3O3 MolecularWeight: 451.94524

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(N=C(C(=O)N1CC(=O)OCC2=CC=CC=C2)NCC3(CCC3)C4=CC=CC=C4)Cl

Isomeric SMILES

CC1=C(N=C(C(=O)N1CC(=O)OCC2=CC=CC=C2)NCC3(CCC3)C4=CC=CC=C4)Cl

InChI

InChI=1S/C25H26ClN3O3/c1-18-22(26)28-23(27-17-25(13-8-14-25)20-11-6-3-7-12-20)24(31)29(18)15-21(30)32-16-19-9-4-2-5-10-19/h2-7,9-12H,8,13-17H2,1H3,(H,27,28)