4-oxidanylidene-3-[[(2S)-oxolan-2-yl]methyl]-2-sulfanylidene-1H-quinazoline-7-carboxylate

Systemtic Name: 4-oxidanylidene-3-[[(2S)-oxolan-2-yl]methyl]-2-sulfanylidene-1H-quinazoline-7-carboxylate Openeye Name: 4-oxo-3-[[(2S)-tetrahydrofuran-2-yl]methyl]-2-thioxo-1H-quinazoline-7-carboxylate CAS Name: 4-oxo-3-[[(2S)-2-oxolanyl]methyl]-2-sulfanylidene-1H-quinazoline-7-carboxylate IUPAC Name: 4-oxo-3-[[(2S)-oxolan-2-yl]methyl]-2-sulfanylidene-1H-quinazoline-7-carboxylate Traditional Name: 4-keto-3-[[(2S)-tetrahydrofuran-2-yl]methyl]-2-thioxo-1H-quinazoline-7-carboxylate Formula: C14H13N2O4S- MolecularWeight: 305.32902

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(OC1)CN2C(=O)C3=C(C=C(C=C3)C(=O)[O-])NC2=S

Isomeric SMILES

C1C[C@H](OC1)CN2C(=O)C3=C(C=C(C=C3)C(=O)[O-])NC2=S

InChI

InChI=1S/C14H14N2O4S/c17-12-10-4-3-8(13(18)19)6-11(10)15-14(21)16(12)7-9-2-1-5-20-9/h3-4,6,9H,1-2,5,7H2,(H,15,21)(H,18,19)/p-1/t9-/m0/s1