methyl 3-[4-oxidanylidene-2-[2-oxidanylidene-2-(2,4,6-trimethylphenyl)ethyl]sulfanyl-quinazolin-3-yl]propanoate

Systemtic Name: methyl 3-[4-oxidanylidene-2-[2-oxidanylidene-2-(2,4,6-trimethylphenyl)ethyl]sulfanyl-quinazolin-3-yl]propanoate Openeye Name: methyl 3-[4-oxo-2-[2-oxo-2-(2,4,6-trimethylphenyl)ethyl]sulfanyl-quinazolin-3-yl]propanoate CAS Name: 3-[4-oxo-2-[[2-oxo-2-(2,4,6-trimethylphenyl)ethyl]thio]-3-quinazolinyl]propanoic acid methyl ester IUPAC Name: methyl 3-[4-oxo-2-[2-oxo-2-(2,4,6-trimethylphenyl)ethyl]sulfanylquinazolin-3-yl]propanoate Traditional Name: 3-[4-keto-2-[(2-keto-2-mesityl-ethyl)thio]quinazolin-3-yl]propionic acid methyl ester Formula: C23H24N2O4S MolecularWeight: 424.51266

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C(=C1)C)C(=O)CSC2=NC3=CC=CC=C3C(=O)N2CCC(=O)OC)C

Isomeric SMILES

CC1=CC(=C(C(=C1)C)C(=O)CSC2=NC3=CC=CC=C3C(=O)N2CCC(=O)OC)C

InChI

InChI=1S/C23H24N2O4S/c1-14-11-15(2)21(16(3)12-14)19(26)13-30-23-24-18-8-6-5-7-17(18)22(28)25(23)10-9-20(27)29-4/h5-8,11-12H,9-10,13H2,1-4H3