3-[2-(6-chloranyl-4-oxidanylidene-2,3-dihydroquinazolin-1-yl)-1-oxidanylidene-butan-2-yl]benzenesulfonamide

Systemtic Name: 3-[2-(6-chloranyl-4-oxidanylidene-2,3-dihydroquinazolin-1-yl)-1-oxidanylidene-butan-2-yl]benzenesulfonamide Openeye Name: 3-[1-(6-chloro-4-oxo-2,3-dihydroquinazolin-1-yl)-1-formyl-propyl]benzenesulfonamide CAS Name: 3-[2-(6-chloro-4-oxo-2,3-dihydroquinazolin-1-yl)-1-oxobutan-2-yl]benzenesulfonamide IUPAC Name: 3-[2-(6-chloro-4-oxo-2,3-dihydroquinazolin-1-yl)-1-oxobutan-2-yl]benzenesulfonamide Traditional Name: 3-[1-(6-chloro-4-keto-2,3-dihydroquinazolin-1-yl)-1-formyl-propyl]benzenesulfonamide Formula: C18H18ClN3O4S MolecularWeight: 407.87122

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C=O)(C1=CC(=CC=C1)S(=O)(=O)N)N2CNC(=O)C3=C2C=CC(=C3)Cl

Isomeric SMILES

CCC(C=O)(C1=CC(=CC=C1)S(=O)(=O)N)N2CNC(=O)C3=C2C=CC(=C3)Cl

InChI

InChI=1S/C18H18ClN3O4S/c1-2-18(10-23,12-4-3-5-14(8-12)27(20,25)26)22-11-21-17(24)15-9-13(19)6-7-16(15)22/h3-10H,2,11H2,1H3,(H,21,24)(H2,20,25,26)