(phenylmethyl) 2-[3-chloranyl-2-methyl-5-[2-(4-methylphenyl)ethylamino]-6-oxidanylidene-pyrazin-1-yl]ethanoate

Systemtic Name: (phenylmethyl) 2-[3-chloranyl-2-methyl-5-[2-(4-methylphenyl)ethylamino]-6-oxidanylidene-pyrazin-1-yl]ethanoate Openeye Name: benzyl 2-[3-chloro-2-methyl-6-oxo-5-[2-(p-tolyl)ethylamino]pyrazin-1-yl]acetate CAS Name: 2-[3-chloro-2-methyl-5-[2-(4-methylphenyl)ethylamino]-6-oxo-1-pyrazinyl]acetic acid (phenylmethyl) ester IUPAC Name: benzyl 2-[3-chloro-2-methyl-5-[2-(4-methylphenyl)ethylamino]-6-oxopyrazin-1-yl]acetate Traditional Name: 2-[5-chloro-2-keto-6-methyl-3-[2-(p-tolyl)ethylamino]pyrazin-1-yl]acetic acid benzyl ester Formula: C23H24ClN3O3 MolecularWeight: 425.90796

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)CCNC2=NC(=C(N(C2=O)CC(=O)OCC3=CC=CC=C3)C)Cl

Isomeric SMILES

CC1=CC=C(C=C1)CCNC2=NC(=C(N(C2=O)CC(=O)OCC3=CC=CC=C3)C)Cl

InChI

InChI=1S/C23H24ClN3O3/c1-16-8-10-18(11-9-16)12-13-25-22-23(29)27(17(2)21(24)26-22)14-20(28)30-15-19-6-4-3-5-7-19/h3-11H,12-15H2,1-2H3,(H,25,26)