(2R)-2-(3-methyl-4-methylidene-quinazolin-2-yl)sulfanyl-N-(4-sulfamoylphenyl)propanamide

Systemtic Name: (2R)-2-(3-methyl-4-methylidene-quinazolin-2-yl)sulfanyl-N-(4-sulfamoylphenyl)propanamide Openeye Name: (2R)-2-(3-methyl-4-methylene-quinazolin-2-yl)sulfanyl-N-(4-sulfamoylphenyl)propanamide CAS Name: (2R)-2-[(3-methyl-4-methylene-2-quinazolinyl)thio]-N-(4-sulfamoylphenyl)propanamide IUPAC Name: (2R)-2-(3-methyl-4-methylidenequinazolin-2-yl)sulfanyl-N-(4-sulfamoylphenyl)propanamide Traditional Name: (2R)-2-[(3-methyl-4-methylene-quinazolin-2-yl)thio]-N-(4-sulfamoylphenyl)propionamide Formula: C19H20N4O3S2 MolecularWeight: 416.5171

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)NC1=CC=C(C=C1)S(=O)(=O)N)SC2=NC3=CC=CC=C3C(=C)N2C

Isomeric SMILES

C[C@H](C(=O)NC1=CC=C(C=C1)S(=O)(=O)N)SC2=NC3=CC=CC=C3C(=C)N2C

InChI

InChI=1S/C19H20N4O3S2/c1-12-16-6-4-5-7-17(16)22-19(23(12)3)27-13(2)18(24)21-14-8-10-15(11-9-14)28(20,25)26/h4-11,13H,1H2,2-3H3,(H,21,24)(H2,20,25,26)/t13-/m1/s1