methyl 2-cyano-2-[3-(1-cyclopropyl-5-phenyl-imidazol-2-yl)sulfanylquinoxalin-2-yl]ethanoate

Systemtic Name: methyl 2-cyano-2-[3-(1-cyclopropyl-5-phenyl-imidazol-2-yl)sulfanylquinoxalin-2-yl]ethanoate Openeye Name: methyl 2-cyano-2-[3-(1-cyclopropyl-5-phenyl-imidazol-2-yl)sulfanylquinoxalin-2-yl]acetate CAS Name: 2-cyano-2-[3-[(1-cyclopropyl-5-phenyl-2-imidazolyl)thio]-2-quinoxalinyl]acetic acid methyl ester IUPAC Name: methyl 2-cyano-2-[3-(1-cyclopropyl-5-phenylimidazol-2-yl)sulfanylquinoxalin-2-yl]acetate Traditional Name: 2-cyano-2-[3-[(1-cyclopropyl-5-phenyl-imidazol-2-yl)thio]quinoxalin-2-yl]acetic acid methyl ester Formula: C24H19N5O2S MolecularWeight: 441.50496

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C(C#N)C1=NC2=CC=CC=C2N=C1SC3=NC=C(N3C4CC4)C5=CC=CC=C5

Isomeric SMILES

COC(=O)C(C#N)C1=NC2=CC=CC=C2N=C1SC3=NC=C(N3C4CC4)C5=CC=CC=C5

InChI

InChI=1S/C24H19N5O2S/c1-31-23(30)17(13-25)21-22(28-19-10-6-5-9-18(19)27-21)32-24-26-14-20(29(24)16-11-12-16)15-7-3-2-4-8-15/h2-10,14,16-17H,11-12H2,1H3