methyl 2-[3-(4-methoxyphenoxy)propylsulfanyl]-4-oxidanylidene-3-[[(2R)-oxolan-2-yl]methyl]quinazoline-7-carboxylate

Systemtic Name: methyl 2-[3-(4-methoxyphenoxy)propylsulfanyl]-4-oxidanylidene-3-[[(2R)-oxolan-2-yl]methyl]quinazoline-7-carboxylate Openeye Name: methyl 2-[3-(4-methoxyphenoxy)propylsulfanyl]-4-oxo-3-[[(2R)-tetrahydrofuran-2-yl]methyl]quinazoline-7-carboxylate CAS Name: 2-[3-(4-methoxyphenoxy)propylthio]-4-oxo-3-[[(2R)-2-oxolanyl]methyl]-7-quinazolinecarboxylic acid methyl ester IUPAC Name: methyl 2-[3-(4-methoxyphenoxy)propylsulfanyl]-4-oxo-3-[[(2R)-oxolan-2-yl]methyl]quinazoline-7-carboxylate Traditional Name: 4-keto-2-[3-(4-methoxyphenoxy)propylthio]-3-[[(2R)-tetrahydrofuran-2-yl]methyl]quinazoline-7-carboxylic acid methyl ester Formula: C25H28N2O6S MolecularWeight: 484.56462

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)OCCCSC2=NC3=C(C=CC(=C3)C(=O)OC)C(=O)N2CC4CCCO4

Isomeric SMILES

COC1=CC=C(C=C1)OCCCSC2=NC3=C(C=CC(=C3)C(=O)OC)C(=O)N2C[C@H]4CCCO4

InChI

InChI=1S/C25H28N2O6S/c1-30-18-7-9-19(10-8-18)32-13-4-14-34-25-26-22-15-17(24(29)31-2)6-11-21(22)23(28)27(25)16-20-5-3-12-33-20/h6-11,15,20H,3-5,12-14,16H2,1-2H3/t20-/m1/s1