methyl 3-[4-oxidanylidene-2-[1-oxidanylidene-1-(2,4,5-trimethylphenyl)propan-2-yl]sulfanyl-quinazolin-3-yl]propanoate

Systemtic Name: methyl 3-[4-oxidanylidene-2-[1-oxidanylidene-1-(2,4,5-trimethylphenyl)propan-2-yl]sulfanyl-quinazolin-3-yl]propanoate Openeye Name: methyl 3-[2-[1-methyl-2-oxo-2-(2,4,5-trimethylphenyl)ethyl]sulfanyl-4-oxo-quinazolin-3-yl]propanoate CAS Name: 3-[4-oxo-2-[[1-oxo-1-(2,4,5-trimethylphenyl)propan-2-yl]thio]-3-quinazolinyl]propanoic acid methyl ester IUPAC Name: methyl 3-[4-oxo-2-[1-oxo-1-(2,4,5-trimethylphenyl)propan-2-yl]sulfanylquinazolin-3-yl]propanoate Traditional Name: 3-[4-keto-2-[[2-keto-1-methyl-2-(2,4,5-trimethylphenyl)ethyl]thio]quinazolin-3-yl]propionic acid methyl ester Formula: C24H26N2O4S MolecularWeight: 438.53924

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1C(=O)C(C)SC2=NC3=CC=CC=C3C(=O)N2CCC(=O)OC)C)C

Isomeric SMILES

CC1=CC(=C(C=C1C(=O)C(C)SC2=NC3=CC=CC=C3C(=O)N2CCC(=O)OC)C)C

InChI

InChI=1S/C24H26N2O4S/c1-14-12-16(3)19(13-15(14)2)22(28)17(4)31-24-25-20-9-7-6-8-18(20)23(29)26(24)11-10-21(27)30-5/h6-9,12-13,17H,10-11H2,1-5H3