[2-oxidanylidene-2-(quinolin-5-ylamino)ethyl] 4-(prop-2-ynylsulfamoyl)benzoate

Systemtic Name: [2-oxidanylidene-2-(quinolin-5-ylamino)ethyl] 4-(prop-2-ynylsulfamoyl)benzoate Openeye Name: [2-oxo-2-(5-quinolylamino)ethyl] 4-(prop-2-ynylsulfamoyl)benzoate CAS Name: 4-(prop-2-ynylsulfamoyl)benzoic acid [2-oxo-2-(5-quinolinylamino)ethyl] ester IUPAC Name: [2-oxo-2-(quinolin-5-ylamino)ethyl] 4-(prop-2-ynylsulfamoyl)benzoate Traditional Name: 4-(propargylsulfamoyl)benzoic acid [2-keto-2-(5-quinolylamino)ethyl] ester Formula: C21H17N3O5S MolecularWeight: 423.44178

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Descriptors Computed from Structure

Canonical SMILES:

C#CCNS(=O)(=O)C1=CC=C(C=C1)C(=O)OCC(=O)NC2=CC=CC3=C2C=CC=N3

Isomeric SMILES

C#CCNS(=O)(=O)C1=CC=C(C=C1)C(=O)OCC(=O)NC2=CC=CC3=C2C=CC=N3

InChI

InChI=1S/C21H17N3O5S/c1-2-12-23-30(27,28)16-10-8-15(9-11-16)21(26)29-14-20(25)24-19-7-3-6-18-17(19)5-4-13-22-18/h1,3-11,13,23H,12,14H2,(H,24,25)