ethyl 2-[6-iodanyl-3-(2-methylprop-2-enyl)-4-oxidanylidene-quinazolin-2-yl]sulfanylpropanoate

Systemtic Name: ethyl 2-[6-iodanyl-3-(2-methylprop-2-enyl)-4-oxidanylidene-quinazolin-2-yl]sulfanylpropanoate Openeye Name: ethyl 2-[6-iodo-3-(2-methylallyl)-4-oxo-quinazolin-2-yl]sulfanylpropanoate CAS Name: 2-[[6-iodo-3-(2-methylprop-2-enyl)-4-oxo-2-quinazolinyl]thio]propanoic acid ethyl ester IUPAC Name: ethyl 2-[6-iodo-3-(2-methylprop-2-enyl)-4-oxoquinazolin-2-yl]sulfanylpropanoate Traditional Name: 2-[[6-iodo-4-keto-3-(2-methylallyl)quinazolin-2-yl]thio]propionic acid ethyl ester Formula: C17H19IN2O3S MolecularWeight: 458.31383

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C(C)SC1=NC2=C(C=C(C=C2)I)C(=O)N1CC(=C)C

Isomeric SMILES

CCOC(=O)C(C)SC1=NC2=C(C=C(C=C2)I)C(=O)N1CC(=C)C

InChI

InChI=1S/C17H19IN2O3S/c1-5-23-16(22)11(4)24-17-19-14-7-6-12(18)8-13(14)15(21)20(17)9-10(2)3/h6-8,11H,2,5,9H2,1,3-4H3