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

Systemtic Name: N-[1-[5-(hydroxymethyl)-4-oxidanyl-oxolan-2-yl]-2-oxidanylidene-pyrimidin-4-yl]-4-oxidanylidene-1H-quinazoline-2-carbothioamide Openeye Name: N-[1-[4-hydroxy-5-(hydroxymethyl)tetrahydrofuran-2-yl]-2-oxo-pyrimidin-4-yl]-4-oxo-1H-quinazoline-2-carbothioamide CAS Name: N-[1-[4-hydroxy-5-(hydroxymethyl)-2-oxolanyl]-2-oxo-4-pyrimidinyl]-4-oxo-1H-quinazoline-2-carbothioamide IUPAC Name: N-[1-[4-hydroxy-5-(hydroxymethyl)oxolan-2-yl]-2-oxopyrimidin-4-yl]-4-oxo-1H-quinazoline-2-carbothioamide Traditional Name: N-[1-(4-hydroxy-5-methylol-tetrahydrofuran-2-yl)-2-keto-pyrimidin-4-yl]-4-keto-1H-quinazoline-2-carbothioamide Formula: C18H17N5O5S MolecularWeight: 415.42308

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Descriptors Computed from Structure

Canonical SMILES:

C1C(C(OC1N2C=CC(=NC2=O)NC(=S)C3=NC(=O)C4=CC=CC=C4N3)CO)O

Isomeric SMILES

C1C(C(OC1N2C=CC(=NC2=O)NC(=S)C3=NC(=O)C4=CC=CC=C4N3)CO)O

InChI

InChI=1S/C18H17N5O5S/c24-8-12-11(25)7-14(28-12)23-6-5-13(21-18(23)27)20-17(29)15-19-10-4-2-1-3-9(10)16(26)22-15/h1-6,11-12,14,24-25H,7-8H2,(H,19,22,26)(H,20,21,27,29)