2-[3-(furan-2-ylmethyl)-4-oxidanylidene-quinazolin-2-yl]sulfanylethanoic acid

Systemtic Name: 2-[3-(furan-2-ylmethyl)-4-oxidanylidene-quinazolin-2-yl]sulfanylethanoic acid Openeye Name: 2-[3-(2-furylmethyl)-4-oxo-quinazolin-2-yl]sulfanylacetic acid CAS Name: 2-[[3-(2-furanylmethyl)-4-oxo-2-quinazolinyl]thio]acetic acid IUPAC Name: 2-[3-(furan-2-ylmethyl)-4-oxoquinazolin-2-yl]sulfanylacetic acid Traditional Name: 2-[[3-(2-furfuryl)-4-keto-quinazolin-2-yl]thio]acetic acid Formula: C15H12N2O4S MolecularWeight: 316.33178

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C(=O)N(C(=N2)SCC(=O)O)CC3=CC=CO3

Isomeric SMILES

C1=CC=C2C(=C1)C(=O)N(C(=N2)SCC(=O)O)CC3=CC=CO3

InChI

InChI=1S/C15H12N2O4S/c18-13(19)9-22-15-16-12-6-2-1-5-11(12)14(20)17(15)8-10-4-3-7-21-10/h1-7H,8-9H2,(H,18,19)