ethyl 3-(4-oxidanylidene-3-prop-2-enyl-quinazolin-2-yl)sulfanylpropanoate

Systemtic Name: ethyl 3-(4-oxidanylidene-3-prop-2-enyl-quinazolin-2-yl)sulfanylpropanoate Openeye Name: ethyl 3-(3-allyl-4-oxo-quinazolin-2-yl)sulfanylpropanoate CAS Name: 3-[(4-oxo-3-prop-2-enyl-2-quinazolinyl)thio]propanoic acid ethyl ester IUPAC Name: ethyl 3-(4-oxo-3-prop-2-enylquinazolin-2-yl)sulfanylpropanoate Traditional Name: 3-[(3-allyl-4-keto-quinazolin-2-yl)thio]propionic acid ethyl ester Formula: C16H18N2O3S MolecularWeight: 318.39072

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)CCSC1=NC2=CC=CC=C2C(=O)N1CC=C

Isomeric SMILES

CCOC(=O)CCSC1=NC2=CC=CC=C2C(=O)N1CC=C

InChI

InChI=1S/C16H18N2O3S/c1-3-10-18-15(20)12-7-5-6-8-13(12)17-16(18)22-11-9-14(19)21-4-2/h3,5-8H,1,4,9-11H2,2H3