N-[1,1-bis(oxidanylidene)thiolan-3-yl]-N-butyl-2-[2-(furan-2-yl)quinazolin-4-yl]sulfanyl-ethanamide

Systemtic Name: N-[1,1-bis(oxidanylidene)thiolan-3-yl]-N-butyl-2-[2-(furan-2-yl)quinazolin-4-yl]sulfanyl-ethanamide Openeye Name: N-butyl-N-(1,1-dioxothiolan-3-yl)-2-[2-(2-furyl)quinazolin-4-yl]sulfanyl-acetamide CAS Name: N-butyl-N-(1,1-dioxo-3-thiolanyl)-2-[[2-(2-furanyl)-4-quinazolinyl]thio]acetamide IUPAC Name: N-butyl-N-(1,1-dioxothiolan-3-yl)-2-[2-(furan-2-yl)quinazolin-4-yl]sulfanylacetamide Traditional Name: N-butyl-N-(1,1-diketothiolan-3-yl)-2-[[2-(2-furyl)quinazolin-4-yl]thio]acetamide Formula: C22H25N3O4S2 MolecularWeight: 459.5816

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Descriptors Computed from Structure

Canonical SMILES:

CCCCN(C1CCS(=O)(=O)C1)C(=O)CSC2=NC(=NC3=CC=CC=C32)C4=CC=CO4

Isomeric SMILES

CCCCN(C1CCS(=O)(=O)C1)C(=O)CSC2=NC(=NC3=CC=CC=C32)C4=CC=CO4

InChI

InChI=1S/C22H25N3O4S2/c1-2-3-11-25(16-10-13-31(27,28)15-16)20(26)14-30-22-17-7-4-5-8-18(17)23-21(24-22)19-9-6-12-29-19/h4-9,12,16H,2-3,10-11,13-15H2,1H3