2-(7-chloranyl-4-oxidanylidene-3-prop-2-enyl-quinazolin-2-yl)sulfanyl-N-(3-sulfamoylphenyl)ethanamide

Systemtic Name: 2-(7-chloranyl-4-oxidanylidene-3-prop-2-enyl-quinazolin-2-yl)sulfanyl-N-(3-sulfamoylphenyl)ethanamide Openeye Name: 2-(3-allyl-7-chloro-4-oxo-quinazolin-2-yl)sulfanyl-N-(3-sulfamoylphenyl)acetamide CAS Name: 2-[(7-chloro-4-oxo-3-prop-2-enyl-2-quinazolinyl)thio]-N-(3-sulfamoylphenyl)acetamide IUPAC Name: 2-(7-chloro-4-oxo-3-prop-2-enylquinazolin-2-yl)sulfanyl-N-(3-sulfamoylphenyl)acetamide Traditional Name: 2-[(3-allyl-7-chloro-4-keto-quinazolin-2-yl)thio]-N-(3-sulfamoylphenyl)acetamide Formula: C19H17ClN4O4S2 MolecularWeight: 464.94568

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C=CCN1C(=O)C2=C(C=C(C=C2)Cl)N=C1SCC(=O)NC3=CC(=CC=C3)S(=O)(=O)N

Isomeric SMILES

C=CCN1C(=O)C2=C(C=C(C=C2)Cl)N=C1SCC(=O)NC3=CC(=CC=C3)S(=O)(=O)N

InChI

InChI=1S/C19H17ClN4O4S2/c1-2-8-24-18(26)15-7-6-12(20)9-16(15)23-19(24)29-11-17(25)22-13-4-3-5-14(10-13)30(21,27)28/h2-7,9-10H,1,8,11H2,(H,22,25)(H2,21,27,28)