S-[2-[4-[2-hydroxyethyl(quinoxalin-6-ylsulfonyl)amino]phenyl]-2-oxidanylidene-ethyl] ethanethioate

Systemtic Name: S-[2-[4-[2-hydroxyethyl(quinoxalin-6-ylsulfonyl)amino]phenyl]-2-oxidanylidene-ethyl] ethanethioate Openeye Name: S-[2-[4-[2-hydroxyethyl(quinoxalin-6-ylsulfonyl)amino]phenyl]-2-oxo-ethyl] ethanethioate CAS Name: ethanethioic acid S-[2-[4-[2-hydroxyethyl(6-quinoxalinylsulfonyl)amino]phenyl]-2-oxoethyl] ester IUPAC Name: S-[2-[4-[2-hydroxyethyl(quinoxalin-6-ylsulfonyl)amino]phenyl]-2-oxoethyl] ethanethioate Traditional Name: ethanethioic acid S-[2-[4-[2-hydroxyethyl(quinoxalin-6-ylsulfonyl)amino]phenyl]-2-keto-ethyl] ester Formula: C20H19N3O5S2 MolecularWeight: 445.51196

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)SCC(=O)C1=CC=C(C=C1)N(CCO)S(=O)(=O)C2=CC3=NC=CN=C3C=C2

Isomeric SMILES

CC(=O)SCC(=O)C1=CC=C(C=C1)N(CCO)S(=O)(=O)C2=CC3=NC=CN=C3C=C2

InChI

InChI=1S/C20H19N3O5S2/c1-14(25)29-13-20(26)15-2-4-16(5-3-15)23(10-11-24)30(27,28)17-6-7-18-19(12-17)22-9-8-21-18/h2-9,12,24H,10-11,13H2,1H3