tert-butyl 2-[3-(furan-2-ylmethyl)-4-oxidanylidene-quinazolin-2-yl]sulfanylethanoate

Systemtic Name: tert-butyl 2-[3-(furan-2-ylmethyl)-4-oxidanylidene-quinazolin-2-yl]sulfanylethanoate Openeye Name: tert-butyl 2-[3-(2-furylmethyl)-4-oxo-quinazolin-2-yl]sulfanylacetate CAS Name: 2-[[3-(2-furanylmethyl)-4-oxo-2-quinazolinyl]thio]acetic acid tert-butyl ester IUPAC Name: tert-butyl 2-[3-(furan-2-ylmethyl)-4-oxoquinazolin-2-yl]sulfanylacetate Traditional Name: 2-[[3-(2-furfuryl)-4-keto-quinazolin-2-yl]thio]acetic acid tert-butyl ester Formula: C19H20N2O4S MolecularWeight: 372.4381

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)CSC1=NC2=CC=CC=C2C(=O)N1CC3=CC=CO3

Isomeric SMILES

CC(C)(C)OC(=O)CSC1=NC2=CC=CC=C2C(=O)N1CC3=CC=CO3

InChI

InChI=1S/C19H20N2O4S/c1-19(2,3)25-16(22)12-26-18-20-15-9-5-4-8-14(15)17(23)21(18)11-13-7-6-10-24-13/h4-10H,11-12H2,1-3H3