[2-[(2-chloranyl-5-methylsulfonyl-phenyl)amino]-2-oxidanylidene-ethyl] 3-quinoxalin-2-ylprop-2-enoate

Systemtic Name: [2-[(2-chloranyl-5-methylsulfonyl-phenyl)amino]-2-oxidanylidene-ethyl] 3-quinoxalin-2-ylprop-2-enoate Openeye Name: [2-(2-chloro-5-methylsulfonyl-anilino)-2-oxo-ethyl] 3-quinoxalin-2-ylprop-2-enoate CAS Name: 3-(2-quinoxalinyl)-2-propenoic acid [2-(2-chloro-5-methylsulfonylanilino)-2-oxoethyl] ester IUPAC Name: [2-(2-chloro-5-methylsulfonylanilino)-2-oxoethyl] 3-quinoxalin-2-ylprop-2-enoate Traditional Name: 3-quinoxalin-2-ylacrylic acid [2-(2-chloro-5-mesyl-anilino)-2-keto-ethyl] ester Formula: C20H16ClN3O5S MolecularWeight: 445.87614

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Descriptors Computed from Structure

Canonical SMILES:

CS(=O)(=O)C1=CC(=C(C=C1)Cl)NC(=O)COC(=O)C=CC2=NC3=CC=CC=C3N=C2

Isomeric SMILES

CS(=O)(=O)C1=CC(=C(C=C1)Cl)NC(=O)COC(=O)C=CC2=NC3=CC=CC=C3N=C2

InChI

InChI=1S/C20H16ClN3O5S/c1-30(27,28)14-7-8-15(21)18(10-14)24-19(25)12-29-20(26)9-6-13-11-22-16-4-2-3-5-17(16)23-13/h2-11H,12H2,1H3,(H,24,25)