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

Systemtic Name: 2-(2-cyclopropylquinazolin-4-yl)sulfanyl-1-(2,3-dihydro-1,4-benzodioxin-6-yl)ethanone Openeye Name: 2-(2-cyclopropylquinazolin-4-yl)sulfanyl-1-(2,3-dihydro-1,4-benzodioxin-6-yl)ethanone CAS Name: 2-[(2-cyclopropyl-4-quinazolinyl)thio]-1-(2,3-dihydro-1,4-benzodioxin-6-yl)ethanone IUPAC Name: 2-(2-cyclopropylquinazolin-4-yl)sulfanyl-1-(2,3-dihydro-1,4-benzodioxin-6-yl)ethanone Traditional Name: 2-[(2-cyclopropylquinazolin-4-yl)thio]-1-(2,3-dihydro-1,4-benzodioxin-6-yl)ethanone Formula: C21H18N2O3S MolecularWeight: 378.44422

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Descriptors Computed from Structure

Canonical SMILES:

C1CC1C2=NC3=CC=CC=C3C(=N2)SCC(=O)C4=CC5=C(C=C4)OCCO5

Isomeric SMILES

C1CC1C2=NC3=CC=CC=C3C(=N2)SCC(=O)C4=CC5=C(C=C4)OCCO5

InChI

InChI=1S/C21H18N2O3S/c24-17(14-7-8-18-19(11-14)26-10-9-25-18)12-27-21-15-3-1-2-4-16(15)22-20(23-21)13-5-6-13/h1-4,7-8,11,13H,5-6,9-10,12H2