ethyl 2-[3-cyclohexyl-7-(furan-2-ylmethylcarbamoyl)-4-oxidanylidene-quinazolin-2-yl]sulfanylethanoate

Systemtic Name: ethyl 2-[3-cyclohexyl-7-(furan-2-ylmethylcarbamoyl)-4-oxidanylidene-quinazolin-2-yl]sulfanylethanoate Openeye Name: ethyl 2-[3-cyclohexyl-7-(2-furylmethylcarbamoyl)-4-oxo-quinazolin-2-yl]sulfanylacetate CAS Name: 2-[[3-cyclohexyl-7-[(2-furanylmethylamino)-oxomethyl]-4-oxo-2-quinazolinyl]thio]acetic acid ethyl ester IUPAC Name: ethyl 2-[3-cyclohexyl-7-(furan-2-ylmethylcarbamoyl)-4-oxoquinazolin-2-yl]sulfanylacetate Traditional Name: 2-[[3-cyclohexyl-7-(2-furfurylcarbamoyl)-4-keto-quinazolin-2-yl]thio]acetic acid ethyl ester Formula: C24H27N3O5S MolecularWeight: 469.55328

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)CSC1=NC2=C(C=CC(=C2)C(=O)NCC3=CC=CO3)C(=O)N1C4CCCCC4

Isomeric SMILES

CCOC(=O)CSC1=NC2=C(C=CC(=C2)C(=O)NCC3=CC=CO3)C(=O)N1C4CCCCC4

InChI

InChI=1S/C24H27N3O5S/c1-2-31-21(28)15-33-24-26-20-13-16(22(29)25-14-18-9-6-12-32-18)10-11-19(20)23(30)27(24)17-7-4-3-5-8-17/h6,9-13,17H,2-5,7-8,14-15H2,1H3,(H,25,29)