[2-[(3-morpholin-4-ylsulfonylphenyl)amino]-2-oxidanylidene-ethyl] 2-oxidanyl-5-(thiophen-2-ylsulfonylamino)benzoate

Systemtic Name: [2-[(3-morpholin-4-ylsulfonylphenyl)amino]-2-oxidanylidene-ethyl] 2-oxidanyl-5-(thiophen-2-ylsulfonylamino)benzoate Openeye Name: [2-(3-morpholinosulfonylanilino)-2-oxo-ethyl] 2-hydroxy-5-(2-thienylsulfonylamino)benzoate CAS Name: 2-hydroxy-5-(thiophen-2-ylsulfonylamino)benzoic acid [2-[3-(4-morpholinylsulfonyl)anilino]-2-oxoethyl] ester IUPAC Name: [2-(3-morpholin-4-ylsulfonylanilino)-2-oxoethyl] 2-hydroxy-5-(thiophen-2-ylsulfonylamino)benzoate Traditional Name: 2-hydroxy-5-(2-thienylsulfonylamino)benzoic acid [2-keto-2-(3-morpholinosulfonylanilino)ethyl] ester Formula: C23H23N3O9S3 MolecularWeight: 581.63842

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Descriptors Computed from Structure

Canonical SMILES:

C1COCCN1S(=O)(=O)C2=CC=CC(=C2)NC(=O)COC(=O)C3=C(C=CC(=C3)NS(=O)(=O)C4=CC=CS4)O

Isomeric SMILES

C1COCCN1S(=O)(=O)C2=CC=CC(=C2)NC(=O)COC(=O)C3=C(C=CC(=C3)NS(=O)(=O)C4=CC=CS4)O

InChI

InChI=1S/C23H23N3O9S3/c27-20-7-6-17(25-37(30,31)22-5-2-12-36-22)14-19(20)23(29)35-15-21(28)24-16-3-1-4-18(13-16)38(32,33)26-8-10-34-11-9-26/h1-7,12-14,25,27H,8-11,15H2,(H,24,28)