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

Systemtic Name: (phenylmethyl) 2-[3-(furan-2-ylmethyl)-4-oxidanylidene-quinazolin-2-yl]sulfanylethanoate Openeye Name: benzyl 2-[3-(2-furylmethyl)-4-oxo-quinazolin-2-yl]sulfanylacetate CAS Name: 2-[[3-(2-furanylmethyl)-4-oxo-2-quinazolinyl]thio]acetic acid (phenylmethyl) ester IUPAC Name: benzyl 2-[3-(furan-2-ylmethyl)-4-oxoquinazolin-2-yl]sulfanylacetate Traditional Name: 2-[[3-(2-furfuryl)-4-keto-quinazolin-2-yl]thio]acetic acid benzyl ester Formula: C22H18N2O4S MolecularWeight: 406.45432

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)COC(=O)CSC2=NC3=CC=CC=C3C(=O)N2CC4=CC=CO4

Isomeric SMILES

C1=CC=C(C=C1)COC(=O)CSC2=NC3=CC=CC=C3C(=O)N2CC4=CC=CO4

InChI

InChI=1S/C22H18N2O4S/c25-20(28-14-16-7-2-1-3-8-16)15-29-22-23-19-11-5-4-10-18(19)21(26)24(22)13-17-9-6-12-27-17/h1-12H,13-15H2