[2-[(4-bromophenyl)amino]-2-oxidanylidene-ethyl] 2-quinoxalin-2-ylsulfanylethanoate

Systemtic Name: [2-[(4-bromophenyl)amino]-2-oxidanylidene-ethyl] 2-quinoxalin-2-ylsulfanylethanoate Openeye Name: [2-(4-bromoanilino)-2-oxo-ethyl] 2-quinoxalin-2-ylsulfanylacetate CAS Name: 2-(2-quinoxalinylthio)acetic acid [2-(4-bromoanilino)-2-oxoethyl] ester IUPAC Name: [2-(4-bromoanilino)-2-oxoethyl] 2-quinoxalin-2-ylsulfanylacetate Traditional Name: 2-(quinoxalin-2-ylthio)acetic acid [2-(4-bromoanilino)-2-keto-ethyl] ester Formula: C18H14BrN3O3S MolecularWeight: 432.29106

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)N=CC(=N2)SCC(=O)OCC(=O)NC3=CC=C(C=C3)Br

Isomeric SMILES

C1=CC=C2C(=C1)N=CC(=N2)SCC(=O)OCC(=O)NC3=CC=C(C=C3)Br

InChI

InChI=1S/C18H14BrN3O3S/c19-12-5-7-13(8-6-12)21-16(23)10-25-18(24)11-26-17-9-20-14-3-1-2-4-15(14)22-17/h1-9H,10-11H2,(H,21,23)