N-(1,3-benzodioxol-5-yl)-2-(2-cyclopropylquinazolin-4-yl)sulfanyl-ethanamide

Systemtic Name: N-(1,3-benzodioxol-5-yl)-2-(2-cyclopropylquinazolin-4-yl)sulfanyl-ethanamide Openeye Name: N-(1,3-benzodioxol-5-yl)-2-(2-cyclopropylquinazolin-4-yl)sulfanyl-acetamide CAS Name: N-(1,3-benzodioxol-5-yl)-2-[(2-cyclopropyl-4-quinazolinyl)thio]acetamide IUPAC Name: N-(1,3-benzodioxol-5-yl)-2-(2-cyclopropylquinazolin-4-yl)sulfanylacetamide Traditional Name: N-(1,3-benzodioxol-5-yl)-2-[(2-cyclopropylquinazolin-4-yl)thio]acetamide Formula: C20H17N3O3S MolecularWeight: 379.43228

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Descriptors Computed from Structure

Canonical SMILES:

C1CC1C2=NC3=CC=CC=C3C(=N2)SCC(=O)NC4=CC5=C(C=C4)OCO5

Isomeric SMILES

C1CC1C2=NC3=CC=CC=C3C(=N2)SCC(=O)NC4=CC5=C(C=C4)OCO5

InChI

InChI=1S/C20H17N3O3S/c24-18(21-13-7-8-16-17(9-13)26-11-25-16)10-27-20-14-3-1-2-4-15(14)22-19(23-20)12-5-6-12/h1-4,7-9,12H,5-6,10-11H2,(H,21,24)