2-(2-tert-butylquinazolin-4-yl)sulfanyl-1-(2,3-dihydro-1,4-benzodioxin-6-yl)ethanone

Systemtic Name: 2-(2-tert-butylquinazolin-4-yl)sulfanyl-1-(2,3-dihydro-1,4-benzodioxin-6-yl)ethanone Openeye Name: 2-(2-tert-butylquinazolin-4-yl)sulfanyl-1-(2,3-dihydro-1,4-benzodioxin-6-yl)ethanone CAS Name: 2-[(2-tert-butyl-4-quinazolinyl)thio]-1-(2,3-dihydro-1,4-benzodioxin-6-yl)ethanone IUPAC Name: 2-(2-tert-butylquinazolin-4-yl)sulfanyl-1-(2,3-dihydro-1,4-benzodioxin-6-yl)ethanone Traditional Name: 2-[(2-tert-butylquinazolin-4-yl)thio]-1-(2,3-dihydro-1,4-benzodioxin-6-yl)ethanone Formula: C22H22N2O3S MolecularWeight: 394.48668

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=NC2=CC=CC=C2C(=N1)SCC(=O)C3=CC4=C(C=C3)OCCO4

Isomeric SMILES

CC(C)(C)C1=NC2=CC=CC=C2C(=N1)SCC(=O)C3=CC4=C(C=C3)OCCO4

InChI

InChI=1S/C22H22N2O3S/c1-22(2,3)21-23-16-7-5-4-6-15(16)20(24-21)28-13-17(25)14-8-9-18-19(12-14)27-11-10-26-18/h4-9,12H,10-11,13H2,1-3H3