2-(3-cyclopropyl-4-oxidanylidene-quinazolin-2-yl)sulfanyl-N-[(4-sulfamoylphenyl)methyl]ethanamide

Systemtic Name: 2-(3-cyclopropyl-4-oxidanylidene-quinazolin-2-yl)sulfanyl-N-[(4-sulfamoylphenyl)methyl]ethanamide Openeye Name: 2-(3-cyclopropyl-4-oxo-quinazolin-2-yl)sulfanyl-N-[(4-sulfamoylphenyl)methyl]acetamide CAS Name: 2-[(3-cyclopropyl-4-oxo-2-quinazolinyl)thio]-N-[(4-sulfamoylphenyl)methyl]acetamide IUPAC Name: 2-(3-cyclopropyl-4-oxoquinazolin-2-yl)sulfanyl-N-[(4-sulfamoylphenyl)methyl]acetamide Traditional Name: 2-[(3-cyclopropyl-4-keto-quinazolin-2-yl)thio]-N-(4-sulfamoylbenzyl)acetamide Formula: C20H20N4O4S2 MolecularWeight: 444.5272

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Descriptors Computed from Structure

Canonical SMILES:

C1CC1N2C(=O)C3=CC=CC=C3N=C2SCC(=O)NCC4=CC=C(C=C4)S(=O)(=O)N

Isomeric SMILES

C1CC1N2C(=O)C3=CC=CC=C3N=C2SCC(=O)NCC4=CC=C(C=C4)S(=O)(=O)N

InChI

InChI=1S/C20H20N4O4S2/c21-30(27,28)15-9-5-13(6-10-15)11-22-18(25)12-29-20-23-17-4-2-1-3-16(17)19(26)24(20)14-7-8-14/h1-6,9-10,14H,7-8,11-12H2,(H,22,25)(H2,21,27,28)