methyl 5-[(6-chloranyl-4-oxidanylidene-3-prop-2-enyl-quinazolin-2-yl)sulfanylmethyl]furan-2-carboxylate

Systemtic Name: methyl 5-[(6-chloranyl-4-oxidanylidene-3-prop-2-enyl-quinazolin-2-yl)sulfanylmethyl]furan-2-carboxylate Openeye Name: methyl 5-[(3-allyl-6-chloro-4-oxo-quinazolin-2-yl)sulfanylmethyl]furan-2-carboxylate CAS Name: 5-[[(6-chloro-4-oxo-3-prop-2-enyl-2-quinazolinyl)thio]methyl]-2-furancarboxylic acid methyl ester IUPAC Name: methyl 5-[(6-chloro-4-oxo-3-prop-2-enylquinazolin-2-yl)sulfanylmethyl]furan-2-carboxylate Traditional Name: 5-[[(3-allyl-6-chloro-4-keto-quinazolin-2-yl)thio]methyl]furan-2-carboxylic acid methyl ester Formula: C18H15ClN2O4S MolecularWeight: 390.8407

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=CC=C(O1)CSC2=NC3=C(C=C(C=C3)Cl)C(=O)N2CC=C

Isomeric SMILES

COC(=O)C1=CC=C(O1)CSC2=NC3=C(C=C(C=C3)Cl)C(=O)N2CC=C

InChI

InChI=1S/C18H15ClN2O4S/c1-3-8-21-16(22)13-9-11(19)4-6-14(13)20-18(21)26-10-12-5-7-15(25-12)17(23)24-2/h3-7,9H,1,8,10H2,2H3