ethyl 4-[2-[4-oxidanylidene-3-(2-propan-2-ylphenyl)quinazolin-2-yl]sulfanylethanoylamino]butanoate

Systemtic Name: ethyl 4-[2-[4-oxidanylidene-3-(2-propan-2-ylphenyl)quinazolin-2-yl]sulfanylethanoylamino]butanoate Openeye Name: ethyl 4-[[2-[3-(2-isopropylphenyl)-4-oxo-quinazolin-2-yl]sulfanylacetyl]amino]butanoate CAS Name: 4-[[1-oxo-2-[[4-oxo-3-(2-propan-2-ylphenyl)-2-quinazolinyl]thio]ethyl]amino]butanoic acid ethyl ester IUPAC Name: ethyl 4-[[2-[4-oxo-3-(2-propan-2-ylphenyl)quinazolin-2-yl]sulfanylacetyl]amino]butanoate Traditional Name: 4-[[2-[(4-keto-3-o-cumenyl-quinazolin-2-yl)thio]acetyl]amino]butyric acid ethyl ester Formula: C25H29N3O4S MolecularWeight: 467.58046

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)CCCNC(=O)CSC1=NC2=CC=CC=C2C(=O)N1C3=CC=CC=C3C(C)C

Isomeric SMILES

CCOC(=O)CCCNC(=O)CSC1=NC2=CC=CC=C2C(=O)N1C3=CC=CC=C3C(C)C

InChI

InChI=1S/C25H29N3O4S/c1-4-32-23(30)14-9-15-26-22(29)16-33-25-27-20-12-7-5-11-19(20)24(31)28(25)21-13-8-6-10-18(21)17(2)3/h5-8,10-13,17H,4,9,14-16H2,1-3H3,(H,26,29)