2-(2-oxidanylideneoxolan-3-yl)sulfanyl-3-(3-pyrrolidin-1-ylsulfonylphenyl)quinazolin-4-one

Systemtic Name: 2-(2-oxidanylideneoxolan-3-yl)sulfanyl-3-(3-pyrrolidin-1-ylsulfonylphenyl)quinazolin-4-one Openeye Name: 2-(2-oxotetrahydrofuran-3-yl)sulfanyl-3-(3-pyrrolidin-1-ylsulfonylphenyl)quinazolin-4-one CAS Name: 2-[(2-oxo-3-oxolanyl)thio]-3-[3-(1-pyrrolidinylsulfonyl)phenyl]-4-quinazolinone IUPAC Name: 2-(2-oxooxolan-3-yl)sulfanyl-3-(3-pyrrolidin-1-ylsulfonylphenyl)quinazolin-4-one Traditional Name: 2-[(2-ketotetrahydrofuran-3-yl)thio]-3-(3-pyrrolidinosulfonylphenyl)quinazolin-4-one Formula: C22H21N3O5S2 MolecularWeight: 471.54924

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(C1)S(=O)(=O)C2=CC=CC(=C2)N3C(=O)C4=CC=CC=C4N=C3SC5CCOC5=O

Isomeric SMILES

C1CCN(C1)S(=O)(=O)C2=CC=CC(=C2)N3C(=O)C4=CC=CC=C4N=C3SC5CCOC5=O

InChI

InChI=1S/C22H21N3O5S2/c26-20-17-8-1-2-9-18(17)23-22(31-19-10-13-30-21(19)27)25(20)15-6-5-7-16(14-15)32(28,29)24-11-3-4-12-24/h1-2,5-9,14,19H,3-4,10-13H2