ethyl 4-[3-[(4-methoxyphenyl)methyl]-4-oxidanylidene-quinazolin-2-yl]sulfanylbutanoate

Systemtic Name: ethyl 4-[3-[(4-methoxyphenyl)methyl]-4-oxidanylidene-quinazolin-2-yl]sulfanylbutanoate Openeye Name: ethyl 4-[3-[(4-methoxyphenyl)methyl]-4-oxo-quinazolin-2-yl]sulfanylbutanoate CAS Name: 4-[[3-[(4-methoxyphenyl)methyl]-4-oxo-2-quinazolinyl]thio]butanoic acid ethyl ester IUPAC Name: ethyl 4-[3-[(4-methoxyphenyl)methyl]-4-oxoquinazolin-2-yl]sulfanylbutanoate Traditional Name: 4-[(4-keto-3-p-anisyl-quinazolin-2-yl)thio]butyric acid ethyl ester Formula: C22H24N2O4S MolecularWeight: 412.50196

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)CCCSC1=NC2=CC=CC=C2C(=O)N1CC3=CC=C(C=C3)OC

Isomeric SMILES

CCOC(=O)CCCSC1=NC2=CC=CC=C2C(=O)N1CC3=CC=C(C=C3)OC

InChI

InChI=1S/C22H24N2O4S/c1-3-28-20(25)9-6-14-29-22-23-19-8-5-4-7-18(19)21(26)24(22)15-16-10-12-17(27-2)13-11-16/h4-5,7-8,10-13H,3,6,9,14-15H2,1-2H3