methyl 4-oxidanylidene-2-(4,5,6,7-tetrahydro-1-benzothiophen-2-ylcarbonyloxymethyl)-1H-quinazoline-7-carboxylate

Systemtic Name: methyl 4-oxidanylidene-2-(4,5,6,7-tetrahydro-1-benzothiophen-2-ylcarbonyloxymethyl)-1H-quinazoline-7-carboxylate Openeye Name: methyl 4-oxo-2-(4,5,6,7-tetrahydrobenzothiophene-2-carbonyloxymethyl)-1H-quinazoline-7-carboxylate CAS Name: 4-oxo-2-[[oxo(4,5,6,7-tetrahydro-1-benzothiophen-2-yl)methoxy]methyl]-1H-quinazoline-7-carboxylic acid methyl ester IUPAC Name: methyl 4-oxo-2-(4,5,6,7-tetrahydro-1-benzothiophene-2-carbonyloxymethyl)-1H-quinazoline-7-carboxylate Traditional Name: 4-keto-2-(4,5,6,7-tetrahydrobenzothiophene-2-carbonyloxymethyl)-1H-quinazoline-7-carboxylic acid methyl ester Formula: C20H18N2O5S MolecularWeight: 398.43232

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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=C(S3)CCCC4

Isomeric SMILES

COC(=O)C1=CC2=C(C=C1)C(=O)N=C(N2)COC(=O)C3=CC4=C(S3)CCCC4

InChI

InChI=1S/C20H18N2O5S/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/h6-9H,2-5,10H2,1H3,(H,21,22,23)