4-oxidanylidene-2-sulfanylidene-3-(thiophen-2-ylmethyl)-1H-quinazoline-7-carboxylate

Systemtic Name: 4-oxidanylidene-2-sulfanylidene-3-(thiophen-2-ylmethyl)-1H-quinazoline-7-carboxylate Openeye Name: 4-oxo-3-(2-thienylmethyl)-2-thioxo-1H-quinazoline-7-carboxylate CAS Name: 4-oxo-2-sulfanylidene-3-(thiophen-2-ylmethyl)-1H-quinazoline-7-carboxylate IUPAC Name: 4-oxo-2-sulfanylidene-3-(thiophen-2-ylmethyl)-1H-quinazoline-7-carboxylate Traditional Name: 4-keto-3-(2-thenyl)-2-thioxo-1H-quinazoline-7-carboxylate Formula: C14H9N2O3S2- MolecularWeight: 317.36286

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Descriptors Computed from Structure

Canonical SMILES:

C1=CSC(=C1)CN2C(=O)C3=C(C=C(C=C3)C(=O)[O-])NC2=S

Isomeric SMILES

C1=CSC(=C1)CN2C(=O)C3=C(C=C(C=C3)C(=O)[O-])NC2=S

InChI

InChI=1S/C14H10N2O3S2/c17-12-10-4-3-8(13(18)19)6-11(10)15-14(20)16(12)7-9-2-1-5-21-9/h1-6H,7H2,(H,15,20)(H,18,19)/p-1