methyl 5-[(4-oxidanylidene-3-propyl-quinazolin-2-yl)sulfanylmethyl]furan-2-carboxylate

Systemtic Name: methyl 5-[(4-oxidanylidene-3-propyl-quinazolin-2-yl)sulfanylmethyl]furan-2-carboxylate Openeye Name: methyl 5-[(4-oxo-3-propyl-quinazolin-2-yl)sulfanylmethyl]furan-2-carboxylate CAS Name: 5-[[(4-oxo-3-propyl-2-quinazolinyl)thio]methyl]-2-furancarboxylic acid methyl ester IUPAC Name: methyl 5-[(4-oxo-3-propylquinazolin-2-yl)sulfanylmethyl]furan-2-carboxylate Traditional Name: 5-[[(4-keto-3-propyl-quinazolin-2-yl)thio]methyl]furan-2-carboxylic acid methyl ester Formula: C18H18N2O4S MolecularWeight: 358.41152

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Descriptors Computed from Structure

Canonical SMILES:

CCCN1C(=O)C2=CC=CC=C2N=C1SCC3=CC=C(O3)C(=O)OC

Isomeric SMILES

CCCN1C(=O)C2=CC=CC=C2N=C1SCC3=CC=C(O3)C(=O)OC

InChI

InChI=1S/C18H18N2O4S/c1-3-10-20-16(21)13-6-4-5-7-14(13)19-18(20)25-11-12-8-9-15(24-12)17(22)23-2/h4-9H,3,10-11H2,1-2H3