1-(4-oxidanylidene-1H-quinazolin-2-yl)ethyl 4-chloranyl-3-sulfamoyl-benzoate

Systemtic Name: 1-(4-oxidanylidene-1H-quinazolin-2-yl)ethyl 4-chloranyl-3-sulfamoyl-benzoate Openeye Name: 1-(4-oxo-1H-quinazolin-2-yl)ethyl 4-chloro-3-sulfamoyl-benzoate CAS Name: 4-chloro-3-sulfamoylbenzoic acid 1-(4-oxo-1H-quinazolin-2-yl)ethyl ester IUPAC Name: 1-(4-oxo-1H-quinazolin-2-yl)ethyl 4-chloro-3-sulfamoylbenzoate Traditional Name: 4-chloro-3-sulfamoyl-benzoic acid 1-(4-keto-1H-quinazolin-2-yl)ethyl ester Formula: C17H14ClN3O5S MolecularWeight: 407.82816

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Descriptors Computed from Structure

Canonical SMILES:

CC(C1=NC(=O)C2=CC=CC=C2N1)OC(=O)C3=CC(=C(C=C3)Cl)S(=O)(=O)N

Isomeric SMILES

CC(C1=NC(=O)C2=CC=CC=C2N1)OC(=O)C3=CC(=C(C=C3)Cl)S(=O)(=O)N

InChI

InChI=1S/C17H14ClN3O5S/c1-9(15-20-13-5-3-2-4-11(13)16(22)21-15)26-17(23)10-6-7-12(18)14(8-10)27(19,24)25/h2-9H,1H3,(H2,19,24,25)(H,20,21,22)