methyl 2-(1-benzothiophen-2-ylcarbonyloxymethyl)-4-oxidanylidene-1H-quinazoline-7-carboxylate

Systemtic Name: methyl 2-(1-benzothiophen-2-ylcarbonyloxymethyl)-4-oxidanylidene-1H-quinazoline-7-carboxylate Openeye Name: methyl 2-(benzothiophene-2-carbonyloxymethyl)-4-oxo-1H-quinazoline-7-carboxylate CAS Name: 2-[[1-benzothiophen-2-yl(oxo)methoxy]methyl]-4-oxo-1H-quinazoline-7-carboxylic acid methyl ester IUPAC Name: methyl 2-(1-benzothiophene-2-carbonyloxymethyl)-4-oxo-1H-quinazoline-7-carboxylate Traditional Name: 2-(benzothiophene-2-carbonyloxymethyl)-4-keto-1H-quinazoline-7-carboxylic acid methyl ester Formula: C20H14N2O5S MolecularWeight: 394.40056

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=CC2=C(C=C1)C(=O)N=C(N2)COC(=O)C3=CC4=CC=CC=C4S3

Isomeric SMILES

COC(=O)C1=CC2=C(C=C1)C(=O)N=C(N2)COC(=O)C3=CC4=CC=CC=C4S3

InChI

InChI=1S/C20H14N2O5S/c1-26-19(24)12-6-7-13-14(8-12)21-17(22-18(13)23)10-27-20(25)16-9-11-4-2-3-5-15(11)28-16/h2-9H,10H2,1H3,(H,21,22,23)