dimethyl 5-azanyl-3-[2-[2,4-bis(oxidanylidene)quinazolin-1-yl]ethanoyloxymethyl]thiophene-2,4-dicarboxylate

Systemtic Name: dimethyl 5-azanyl-3-[2-[2,4-bis(oxidanylidene)quinazolin-1-yl]ethanoyloxymethyl]thiophene-2,4-dicarboxylate Openeye Name: dimethyl 5-amino-3-[[2-(2,4-dioxoquinazolin-1-yl)acetyl]oxymethyl]thiophene-2,4-dicarboxylate CAS Name: 5-amino-3-[[2-(2,4-dioxo-1-quinazolinyl)-1-oxoethoxy]methyl]thiophene-2,4-dicarboxylic acid dimethyl ester IUPAC Name: dimethyl 5-amino-3-[[2-(2,4-dioxoquinazolin-1-yl)acetyl]oxymethyl]thiophene-2,4-dicarboxylate Traditional Name: 5-amino-3-[[2-(2,4-diketoquinazolin-1-yl)acetyl]oxymethyl]thiophene-2,4-dicarboxylic acid dimethyl ester Formula: C19H17N3O8S MolecularWeight: 447.41858

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=C(SC(=C1COC(=O)CN2C3=CC=CC=C3C(=O)NC2=O)C(=O)OC)N

Isomeric SMILES

COC(=O)C1=C(SC(=C1COC(=O)CN2C3=CC=CC=C3C(=O)NC2=O)C(=O)OC)N

InChI

InChI=1S/C19H17N3O8S/c1-28-17(25)13-10(14(18(26)29-2)31-15(13)20)8-30-12(23)7-22-11-6-4-3-5-9(11)16(24)21-19(22)27/h3-6H,7-8,20H2,1-2H3,(H,21,24,27)