4-tert-butyl-N-ethyl-N-[(4-oxidanylidene-1H-quinazolin-2-yl)methyl]benzenesulfonamide

Systemtic Name: 4-tert-butyl-N-ethyl-N-[(4-oxidanylidene-1H-quinazolin-2-yl)methyl]benzenesulfonamide Openeye Name: 4-tert-butyl-N-ethyl-N-[(4-oxo-1H-quinazolin-2-yl)methyl]benzenesulfonamide CAS Name: 4-tert-butyl-N-ethyl-N-[(4-oxo-1H-quinazolin-2-yl)methyl]benzenesulfonamide IUPAC Name: 4-tert-butyl-N-ethyl-N-[(4-oxo-1H-quinazolin-2-yl)methyl]benzenesulfonamide Traditional Name: 4-tert-butyl-N-ethyl-N-[(4-keto-1H-quinazolin-2-yl)methyl]benzenesulfonamide Formula: C21H25N3O3S MolecularWeight: 399.5065

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC1=NC(=O)C2=CC=CC=C2N1)S(=O)(=O)C3=CC=C(C=C3)C(C)(C)C

Isomeric SMILES

CCN(CC1=NC(=O)C2=CC=CC=C2N1)S(=O)(=O)C3=CC=C(C=C3)C(C)(C)C

InChI

InChI=1S/C21H25N3O3S/c1-5-24(14-19-22-18-9-7-6-8-17(18)20(25)23-19)28(26,27)16-12-10-15(11-13-16)21(2,3)4/h6-13H,5,14H2,1-4H3,(H,22,23,25)