butyl 2-(4-oxidanylidene-3-phenyl-quinazolin-2-yl)sulfanylethanoate

Systemtic Name: butyl 2-(4-oxidanylidene-3-phenyl-quinazolin-2-yl)sulfanylethanoate Openeye Name: butyl 2-(4-oxo-3-phenyl-quinazolin-2-yl)sulfanylacetate CAS Name: 2-[(4-oxo-3-phenyl-2-quinazolinyl)thio]acetic acid butyl ester IUPAC Name: butyl 2-(4-oxo-3-phenylquinazolin-2-yl)sulfanylacetate Traditional Name: 2-[(4-keto-3-phenyl-quinazolin-2-yl)thio]acetic acid butyl ester Formula: C20H20N2O3S MolecularWeight: 368.4494

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Descriptors Computed from Structure

Canonical SMILES:

CCCCOC(=O)CSC1=NC2=CC=CC=C2C(=O)N1C3=CC=CC=C3

Isomeric SMILES

CCCCOC(=O)CSC1=NC2=CC=CC=C2C(=O)N1C3=CC=CC=C3

InChI

InChI=1S/C20H20N2O3S/c1-2-3-13-25-18(23)14-26-20-21-17-12-8-7-11-16(17)19(24)22(20)15-9-5-4-6-10-15/h4-12H,2-3,13-14H2,1H3