4-chloranyl-N-(4,7,7-trimethyl-5-oxidanylidene-6,8-dihydroquinazolin-2-yl)benzenesulfonamide

Systemtic Name: 4-chloranyl-N-(4,7,7-trimethyl-5-oxidanylidene-6,8-dihydroquinazolin-2-yl)benzenesulfonamide Openeye Name: 4-chloro-N-(4,7,7-trimethyl-5-oxo-6,8-dihydroquinazolin-2-yl)benzenesulfonamide CAS Name: 4-chloro-N-(4,7,7-trimethyl-5-oxo-6,8-dihydroquinazolin-2-yl)benzenesulfonamide IUPAC Name: 4-chloro-N-(4,7,7-trimethyl-5-oxo-6,8-dihydroquinazolin-2-yl)benzenesulfonamide Traditional Name: 4-chloro-N-(5-keto-4,7,7-trimethyl-6,8-dihydroquinazolin-2-yl)benzenesulfonamide Formula: C17H18ClN3O3S MolecularWeight: 379.86112

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC(=NC2=C1C(=O)CC(C2)(C)C)NS(=O)(=O)C3=CC=C(C=C3)Cl

Isomeric SMILES

CC1=NC(=NC2=C1C(=O)CC(C2)(C)C)NS(=O)(=O)C3=CC=C(C=C3)Cl

InChI

InChI=1S/C17H18ClN3O3S/c1-10-15-13(8-17(2,3)9-14(15)22)20-16(19-10)21-25(23,24)12-6-4-11(18)5-7-12/h4-7H,8-9H2,1-3H3,(H,19,20,21)