methyl 5-[[7-chloranyl-4-oxidanylidene-3-[[(2R)-oxolan-2-yl]methyl]quinazolin-2-yl]sulfanylmethyl]-2-methyl-furan-3-carboxylate

Systemtic Name: methyl 5-[[7-chloranyl-4-oxidanylidene-3-[[(2R)-oxolan-2-yl]methyl]quinazolin-2-yl]sulfanylmethyl]-2-methyl-furan-3-carboxylate Openeye Name: methyl 5-[[7-chloro-4-oxo-3-[[(2R)-tetrahydrofuran-2-yl]methyl]quinazolin-2-yl]sulfanylmethyl]-2-methyl-furan-3-carboxylate CAS Name: 5-[[[7-chloro-4-oxo-3-[[(2R)-2-oxolanyl]methyl]-2-quinazolinyl]thio]methyl]-2-methyl-3-furancarboxylic acid methyl ester IUPAC Name: methyl 5-[[7-chloro-4-oxo-3-[[(2R)-oxolan-2-yl]methyl]quinazolin-2-yl]sulfanylmethyl]-2-methylfuran-3-carboxylate Traditional Name: 5-[[[7-chloro-4-keto-3-[[(2R)-tetrahydrofuran-2-yl]methyl]quinazolin-2-yl]thio]methyl]-2-methyl-furan-3-carboxylic acid methyl ester Formula: C21H21ClN2O5S MolecularWeight: 448.91984

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(O1)CSC2=NC3=C(C=CC(=C3)Cl)C(=O)N2CC4CCCO4)C(=O)OC

Isomeric SMILES

CC1=C(C=C(O1)CSC2=NC3=C(C=CC(=C3)Cl)C(=O)N2C[C@H]4CCCO4)C(=O)OC

InChI

InChI=1S/C21H21ClN2O5S/c1-12-17(20(26)27-2)9-15(29-12)11-30-21-23-18-8-13(22)5-6-16(18)19(25)24(21)10-14-4-3-7-28-14/h5-6,8-9,14H,3-4,7,10-11H2,1-2H3/t14-/m1/s1