4-butyl-1-(2-oxidanylideneoxolan-3-yl)sulfanyl-[1,2,4]triazolo[4,3-a]quinazolin-5-one

Systemtic Name: 4-butyl-1-(2-oxidanylideneoxolan-3-yl)sulfanyl-[1,2,4]triazolo[4,3-a]quinazolin-5-one Openeye Name: 4-butyl-1-(2-oxotetrahydrofuran-3-yl)sulfanyl-[1,2,4]triazolo[4,3-a]quinazolin-5-one CAS Name: 4-butyl-1-[(2-oxo-3-oxolanyl)thio]-[1,2,4]triazolo[4,3-a]quinazolin-5-one IUPAC Name: 4-butyl-1-(2-oxooxolan-3-yl)sulfanyl-[1,2,4]triazolo[4,3-a]quinazolin-5-one Traditional Name: 4-butyl-1-[(2-ketotetrahydrofuran-3-yl)thio]-[1,2,4]triazolo[4,3-a]quinazolin-5-one Formula: C17H18N4O3S MolecularWeight: 358.41482

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Descriptors Computed from Structure

Canonical SMILES:

CCCCN1C(=O)C2=CC=CC=C2N3C1=NN=C3SC4CCOC4=O

Isomeric SMILES

CCCCN1C(=O)C2=CC=CC=C2N3C1=NN=C3SC4CCOC4=O

InChI

InChI=1S/C17H18N4O3S/c1-2-3-9-20-14(22)11-6-4-5-7-12(11)21-16(20)18-19-17(21)25-13-8-10-24-15(13)23/h4-7,13H,2-3,8-10H2,1H3