ethyl 2-(3-butyl-4-oxidanylidene-quinazolin-2-yl)sulfanylpropanoate

Systemtic Name: ethyl 2-(3-butyl-4-oxidanylidene-quinazolin-2-yl)sulfanylpropanoate Openeye Name: ethyl 2-(3-butyl-4-oxo-quinazolin-2-yl)sulfanylpropanoate CAS Name: 2-[(3-butyl-4-oxo-2-quinazolinyl)thio]propanoic acid ethyl ester IUPAC Name: ethyl 2-(3-butyl-4-oxoquinazolin-2-yl)sulfanylpropanoate Traditional Name: 2-[(3-butyl-4-keto-quinazolin-2-yl)thio]propionic acid ethyl ester Formula: C17H22N2O3S MolecularWeight: 334.43318

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Descriptors Computed from Structure

Canonical SMILES:

CCCCN1C(=O)C2=CC=CC=C2N=C1SC(C)C(=O)OCC

Isomeric SMILES

CCCCN1C(=O)C2=CC=CC=C2N=C1SC(C)C(=O)OCC

InChI

InChI=1S/C17H22N2O3S/c1-4-6-11-19-15(20)13-9-7-8-10-14(13)18-17(19)23-12(3)16(21)22-5-2/h7-10,12H,4-6,11H2,1-3H3