butyl 2-[3-(2-ethoxyphenyl)-4-oxidanylidene-quinazolin-2-yl]sulfanylethanoate

Systemtic Name: butyl 2-[3-(2-ethoxyphenyl)-4-oxidanylidene-quinazolin-2-yl]sulfanylethanoate Openeye Name: butyl 2-[3-(2-ethoxyphenyl)-4-oxo-quinazolin-2-yl]sulfanylacetate CAS Name: 2-[[3-(2-ethoxyphenyl)-4-oxo-2-quinazolinyl]thio]acetic acid butyl ester IUPAC Name: butyl 2-[3-(2-ethoxyphenyl)-4-oxoquinazolin-2-yl]sulfanylacetate Traditional Name: 2-[(4-keto-3-o-phenetyl-quinazolin-2-yl)thio]acetic acid butyl ester Formula: C22H24N2O4S MolecularWeight: 412.50196

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Descriptors Computed from Structure

Canonical SMILES:

CCCCOC(=O)CSC1=NC2=CC=CC=C2C(=O)N1C3=CC=CC=C3OCC

Isomeric SMILES

CCCCOC(=O)CSC1=NC2=CC=CC=C2C(=O)N1C3=CC=CC=C3OCC

InChI

InChI=1S/C22H24N2O4S/c1-3-5-14-28-20(25)15-29-22-23-17-11-7-6-10-16(17)21(26)24(22)18-12-8-9-13-19(18)27-4-2/h6-13H,3-5,14-15H2,1-2H3