N-[1-(1,3-benzodioxol-5-yl)ethyl]-2-(3-butyl-4-oxidanylidene-quinazolin-2-yl)sulfanyl-ethanamide

Systemtic Name: N-[1-(1,3-benzodioxol-5-yl)ethyl]-2-(3-butyl-4-oxidanylidene-quinazolin-2-yl)sulfanyl-ethanamide Openeye Name: N-[1-(1,3-benzodioxol-5-yl)ethyl]-2-(3-butyl-4-oxo-quinazolin-2-yl)sulfanyl-acetamide CAS Name: N-[1-(1,3-benzodioxol-5-yl)ethyl]-2-[(3-butyl-4-oxo-2-quinazolinyl)thio]acetamide IUPAC Name: N-[1-(1,3-benzodioxol-5-yl)ethyl]-2-(3-butyl-4-oxoquinazolin-2-yl)sulfanylacetamide Traditional Name: N-[1-(1,3-benzodioxol-5-yl)ethyl]-2-[(3-butyl-4-keto-quinazolin-2-yl)thio]acetamide Formula: C23H25N3O4S MolecularWeight: 439.5273

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Descriptors Computed from Structure

Canonical SMILES:

CCCCN1C(=O)C2=CC=CC=C2N=C1SCC(=O)NC(C)C3=CC4=C(C=C3)OCO4

Isomeric SMILES

CCCCN1C(=O)C2=CC=CC=C2N=C1SCC(=O)NC(C)C3=CC4=C(C=C3)OCO4

InChI

InChI=1S/C23H25N3O4S/c1-3-4-11-26-22(28)17-7-5-6-8-18(17)25-23(26)31-13-21(27)24-15(2)16-9-10-19-20(12-16)30-14-29-19/h5-10,12,15H,3-4,11,13-14H2,1-2H3,(H,24,27)