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

Systemtic Name: (phenylmethyl) 2-[5-chloranyl-3-[3-(dimethylamino)propylamino]-2-oxidanylidene-6-phenyl-pyrazin-1-yl]ethanoate Openeye Name: benzyl 2-[5-chloro-3-[3-(dimethylamino)propylamino]-2-oxo-6-phenyl-pyrazin-1-yl]acetate CAS Name: 2-[5-chloro-3-[3-(dimethylamino)propylamino]-2-oxo-6-phenyl-1-pyrazinyl]acetic acid (phenylmethyl) ester IUPAC Name: benzyl 2-[5-chloro-3-[3-(dimethylamino)propylamino]-2-oxo-6-phenylpyrazin-1-yl]acetate Traditional Name: 2-[5-chloro-3-[3-(dimethylamino)propylamino]-2-keto-6-phenyl-pyrazin-1-yl]acetic acid benzyl ester Formula: C24H27ClN4O3 MolecularWeight: 454.94918

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Descriptors Computed from Structure

Canonical SMILES:

CN(C)CCCNC1=NC(=C(N(C1=O)CC(=O)OCC2=CC=CC=C2)C3=CC=CC=C3)Cl

Isomeric SMILES

CN(C)CCCNC1=NC(=C(N(C1=O)CC(=O)OCC2=CC=CC=C2)C3=CC=CC=C3)Cl

InChI

InChI=1S/C24H27ClN4O3/c1-28(2)15-9-14-26-23-24(31)29(16-20(30)32-17-18-10-5-3-6-11-18)21(22(25)27-23)19-12-7-4-8-13-19/h3-8,10-13H,9,14-17H2,1-2H3,(H,26,27)