3-(3-methoxypropyl)-2-(2-oxidanylideneoxolan-3-yl)sulfanyl-[1]benzothiolo[3,2-d]pyrimidin-4-one

Systemtic Name: 3-(3-methoxypropyl)-2-(2-oxidanylideneoxolan-3-yl)sulfanyl-[1]benzothiolo[3,2-d]pyrimidin-4-one Openeye Name: 3-(3-methoxypropyl)-2-(2-oxotetrahydrofuran-3-yl)sulfanyl-benzothiopheno[3,2-d]pyrimidin-4-one CAS Name: 3-(3-methoxypropyl)-2-[(2-oxo-3-oxolanyl)thio]-[1]benzothiolo[3,2-d]pyrimidin-4-one IUPAC Name: 3-(3-methoxypropyl)-2-(2-oxooxolan-3-yl)sulfanyl-[1]benzothiolo[3,2-d]pyrimidin-4-one Traditional Name: 2-[(2-ketotetrahydrofuran-3-yl)thio]-3-(3-methoxypropyl)benzothiopheno[3,2-d]pyrimidin-4-one Formula: C18H18N2O4S2 MolecularWeight: 390.47652

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Descriptors Computed from Structure

Canonical SMILES:

COCCCN1C(=O)C2=C(C3=CC=CC=C3S2)N=C1SC4CCOC4=O

Isomeric SMILES

COCCCN1C(=O)C2=C(C3=CC=CC=C3S2)N=C1SC4CCOC4=O

InChI

InChI=1S/C18H18N2O4S2/c1-23-9-4-8-20-16(21)15-14(11-5-2-3-6-12(11)25-15)19-18(20)26-13-7-10-24-17(13)22/h2-3,5-6,13H,4,7-10H2,1H3