N-[1-[5-(hydroxymethyl)-3,4-bis(oxidanyl)oxolan-2-yl]-2-oxidanylidene-pyrimidin-4-yl]-4-oxidanylidene-1H-quinazoline-2-carbothioamide

Systemtic Name: N-[1-[5-(hydroxymethyl)-3,4-bis(oxidanyl)oxolan-2-yl]-2-oxidanylidene-pyrimidin-4-yl]-4-oxidanylidene-1H-quinazoline-2-carbothioamide Openeye Name: N-[1-[3,4-dihydroxy-5-(hydroxymethyl)tetrahydrofuran-2-yl]-2-oxo-pyrimidin-4-yl]-4-oxo-1H-quinazoline-2-carbothioamide CAS Name: N-[1-[3,4-dihydroxy-5-(hydroxymethyl)-2-oxolanyl]-2-oxo-4-pyrimidinyl]-4-oxo-1H-quinazoline-2-carbothioamide IUPAC Name: N-[1-[3,4-dihydroxy-5-(hydroxymethyl)oxolan-2-yl]-2-oxopyrimidin-4-yl]-4-oxo-1H-quinazoline-2-carbothioamide Traditional Name: N-[1-(3,4-dihydroxy-5-methylol-tetrahydrofuran-2-yl)-2-keto-pyrimidin-4-yl]-4-keto-1H-quinazoline-2-carbothioamide Formula: C18H17N5O6S MolecularWeight: 431.42248

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C(=O)N=C(N2)C(=S)NC3=NC(=O)N(C=C3)C4C(C(C(O4)CO)O)O

Isomeric SMILES

C1=CC=C2C(=C1)C(=O)N=C(N2)C(=S)NC3=NC(=O)N(C=C3)C4C(C(C(O4)CO)O)O

InChI

InChI=1S/C18H17N5O6S/c24-7-10-12(25)13(26)17(29-10)23-6-5-11(21-18(23)28)20-16(30)14-19-9-4-2-1-3-8(9)15(27)22-14/h1-6,10,12-13,17,24-26H,7H2,(H,19,22,27)(H,20,21,28,30)