methyl 4-oxidanylidene-2-[2-(thiophen-2-ylcarbonylamino)ethanoyloxymethyl]-1H-quinazoline-7-carboxylate

Systemtic Name: methyl 4-oxidanylidene-2-[2-(thiophen-2-ylcarbonylamino)ethanoyloxymethyl]-1H-quinazoline-7-carboxylate Openeye Name: methyl 4-oxo-2-[[2-(thiophene-2-carbonylamino)acetyl]oxymethyl]-1H-quinazoline-7-carboxylate CAS Name: 4-oxo-2-[[1-oxo-2-[[oxo(thiophen-2-yl)methyl]amino]ethoxy]methyl]-1H-quinazoline-7-carboxylic acid methyl ester IUPAC Name: methyl 4-oxo-2-[[2-(thiophene-2-carbonylamino)acetyl]oxymethyl]-1H-quinazoline-7-carboxylate Traditional Name: 4-keto-2-[[2-(2-thenoylamino)acetyl]oxymethyl]-1H-quinazoline-7-carboxylic acid methyl ester Formula: C18H15N3O6S MolecularWeight: 401.3932

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=CC2=C(C=C1)C(=O)N=C(N2)COC(=O)CNC(=O)C3=CC=CS3

Isomeric SMILES

COC(=O)C1=CC2=C(C=C1)C(=O)N=C(N2)COC(=O)CNC(=O)C3=CC=CS3

InChI

InChI=1S/C18H15N3O6S/c1-26-18(25)10-4-5-11-12(7-10)20-14(21-16(11)23)9-27-15(22)8-19-17(24)13-3-2-6-28-13/h2-7H,8-9H2,1H3,(H,19,24)(H,20,21,23)