3-(3,4-dimethoxyphenyl)-2-[2-oxidanylidene-2-(2-oxidanylidenepyrrolidin-1-yl)ethyl]sulfanyl-quinazolin-4-one

Systemtic Name: 3-(3,4-dimethoxyphenyl)-2-[2-oxidanylidene-2-(2-oxidanylidenepyrrolidin-1-yl)ethyl]sulfanyl-quinazolin-4-one Openeye Name: 3-(3,4-dimethoxyphenyl)-2-[2-oxo-2-(2-oxopyrrolidin-1-yl)ethyl]sulfanyl-quinazolin-4-one CAS Name: 3-(3,4-dimethoxyphenyl)-2-[[2-oxo-2-(2-oxo-1-pyrrolidinyl)ethyl]thio]-4-quinazolinone IUPAC Name: 3-(3,4-dimethoxyphenyl)-2-[2-oxo-2-(2-oxopyrrolidin-1-yl)ethyl]sulfanylquinazolin-4-one Traditional Name: 3-(3,4-dimethoxyphenyl)-2-[[2-keto-2-(2-ketopyrrolidino)ethyl]thio]quinazolin-4-one Formula: C22H21N3O5S MolecularWeight: 439.48424

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)N2C(=O)C3=CC=CC=C3N=C2SCC(=O)N4CCCC4=O)OC

Isomeric SMILES

COC1=C(C=C(C=C1)N2C(=O)C3=CC=CC=C3N=C2SCC(=O)N4CCCC4=O)OC

InChI

InChI=1S/C22H21N3O5S/c1-29-17-10-9-14(12-18(17)30-2)25-21(28)15-6-3-4-7-16(15)23-22(25)31-13-20(27)24-11-5-8-19(24)26/h3-4,6-7,9-10,12H,5,8,11,13H2,1-2H3