ethyl 2-[6-(4-chlorophenyl)-4-methyl-1,3-bis(oxidanylidene)-7,8-dihydropurino[7,8-a]imidazol-2-yl]ethanoate

Systemtic Name: ethyl 2-[6-(4-chlorophenyl)-4-methyl-1,3-bis(oxidanylidene)-7,8-dihydropurino[7,8-a]imidazol-2-yl]ethanoate Openeye Name: ethyl 2-[6-(4-chlorophenyl)-4-methyl-1,3-dioxo-7,8-dihydropurino[7,8-a]imidazol-2-yl]acetate CAS Name: 2-[6-(4-chlorophenyl)-4-methyl-1,3-dioxo-7,8-dihydropurino[7,8-a]imidazol-2-yl]acetic acid ethyl ester IUPAC Name: ethyl 2-[6-(4-chlorophenyl)-4-methyl-1,3-dioxo-7,8-dihydropurino[7,8-a]imidazol-2-yl]acetate Traditional Name: 2-[6-(4-chlorophenyl)-1,3-diketo-4-methyl-7,8-dihydropurin[7,8-a]imidazol-2-yl]acetic acid ethyl ester Formula: C18H18ClN5O4 MolecularWeight: 403.81962

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)CN1C(=O)C2=C(N=C3N2CCN3C4=CC=C(C=C4)Cl)N(C1=O)C

Isomeric SMILES

CCOC(=O)CN1C(=O)C2=C(N=C3N2CCN3C4=CC=C(C=C4)Cl)N(C1=O)C

InChI

InChI=1S/C18H18ClN5O4/c1-3-28-13(25)10-24-16(26)14-15(21(2)18(24)27)20-17-22(8-9-23(14)17)12-6-4-11(19)5-7-12/h4-7H,3,8-10H2,1-2H3