3-(3,4-dimethoxyphenyl)-2-[(3S)-2-oxidanylideneoxolan-3-yl]sulfanyl-quinazolin-4-one

Systemtic Name: 3-(3,4-dimethoxyphenyl)-2-[(3S)-2-oxidanylideneoxolan-3-yl]sulfanyl-quinazolin-4-one Openeye Name: 3-(3,4-dimethoxyphenyl)-2-[(3S)-2-oxotetrahydrofuran-3-yl]sulfanyl-quinazolin-4-one CAS Name: 3-(3,4-dimethoxyphenyl)-2-[[(3S)-2-oxo-3-oxolanyl]thio]-4-quinazolinone IUPAC Name: 3-(3,4-dimethoxyphenyl)-2-[(3S)-2-oxooxolan-3-yl]sulfanylquinazolin-4-one Traditional Name: 3-(3,4-dimethoxyphenyl)-2-[[(3S)-2-ketotetrahydrofuran-3-yl]thio]quinazolin-4-one Formula: C20H18N2O5S MolecularWeight: 398.43232

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)N2C(=O)C3=CC=CC=C3N=C2SC4CCOC4=O)OC

Isomeric SMILES

COC1=C(C=C(C=C1)N2C(=O)C3=CC=CC=C3N=C2S[C@H]4CCOC4=O)OC

InChI

InChI=1S/C20H18N2O5S/c1-25-15-8-7-12(11-16(15)26-2)22-18(23)13-5-3-4-6-14(13)21-20(22)28-17-9-10-27-19(17)24/h3-8,11,17H,9-10H2,1-2H3/t17-/m0/s1