2-[[4-oxidanylidene-3-(3-oxidanylpropyl)quinazolin-2-yl]sulfanylmethyl]-1H-thieno[3,2-d]pyrimidin-4-one

Systemtic Name: 2-[[4-oxidanylidene-3-(3-oxidanylpropyl)quinazolin-2-yl]sulfanylmethyl]-1H-thieno[3,2-d]pyrimidin-4-one Openeye Name: 2-[[3-(3-hydroxypropyl)-4-oxo-quinazolin-2-yl]sulfanylmethyl]-1H-thieno[3,2-d]pyrimidin-4-one CAS Name: 2-[[[3-(3-hydroxypropyl)-4-oxo-2-quinazolinyl]thio]methyl]-1H-thieno[3,2-d]pyrimidin-4-one IUPAC Name: 2-[[3-(3-hydroxypropyl)-4-oxoquinazolin-2-yl]sulfanylmethyl]-1H-thieno[3,2-d]pyrimidin-4-one Traditional Name: 2-[[[3-(3-hydroxypropyl)-4-keto-quinazolin-2-yl]thio]methyl]-1H-thieno[3,2-d]pyrimidin-4-one Formula: C18H16N4O3S2 MolecularWeight: 400.47464

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C(=O)N(C(=N2)SCC3=NC(=O)C4=C(N3)C=CS4)CCCO

Isomeric SMILES

C1=CC=C2C(=C1)C(=O)N(C(=N2)SCC3=NC(=O)C4=C(N3)C=CS4)CCCO

InChI

InChI=1S/C18H16N4O3S2/c23-8-3-7-22-17(25)11-4-1-2-5-12(11)20-18(22)27-10-14-19-13-6-9-26-15(13)16(24)21-14/h1-2,4-6,9,23H,3,7-8,10H2,(H,19,21,24)