4-azanyl-1-[3,4,5-tris(oxidanyl)oxan-2-yl]quinazoline-2-thione

Systemtic Name: 4-azanyl-1-[3,4,5-tris(oxidanyl)oxan-2-yl]quinazoline-2-thione Openeye Name: 4-amino-1-(3,4,5-trihydroxytetrahydropyran-2-yl)quinazoline-2-thione CAS Name: 4-amino-1-(3,4,5-trihydroxy-2-oxanyl)-2-quinazolinethione IUPAC Name: 4-amino-1-(3,4,5-trihydroxyoxan-2-yl)quinazoline-2-thione Traditional Name: 4-amino-1-(3,4,5-trihydroxytetrahydropyran-2-yl)quinazoline-2-thione Formula: C13H15N3O4S MolecularWeight: 309.3409

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Descriptors Computed from Structure

Canonical SMILES:

C1C(C(C(C(O1)N2C3=CC=CC=C3C(=NC2=S)N)O)O)O

Isomeric SMILES

C1C(C(C(C(O1)N2C3=CC=CC=C3C(=NC2=S)N)O)O)O

InChI

InChI=1S/C13H15N3O4S/c14-11-6-3-1-2-4-7(6)16(13(21)15-11)12-10(19)9(18)8(17)5-20-12/h1-4,8-10,12,17-19H,5H2,(H2,14,15,21)