methyl 3-[4-oxidanylidene-2-[2-oxidanylidene-2-(2-phenoxyethylamino)ethyl]sulfanyl-quinazolin-3-yl]propanoate

Systemtic Name: methyl 3-[4-oxidanylidene-2-[2-oxidanylidene-2-(2-phenoxyethylamino)ethyl]sulfanyl-quinazolin-3-yl]propanoate Openeye Name: methyl 3-[4-oxo-2-[2-oxo-2-(2-phenoxyethylamino)ethyl]sulfanyl-quinazolin-3-yl]propanoate CAS Name: 3-[4-oxo-2-[[2-oxo-2-(2-phenoxyethylamino)ethyl]thio]-3-quinazolinyl]propanoic acid methyl ester IUPAC Name: methyl 3-[4-oxo-2-[2-oxo-2-(2-phenoxyethylamino)ethyl]sulfanylquinazolin-3-yl]propanoate Traditional Name: 3-[4-keto-2-[[2-keto-2-(2-phenoxyethylamino)ethyl]thio]quinazolin-3-yl]propionic acid methyl ester Formula: C22H23N3O5S MolecularWeight: 441.50012

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC(=O)CCN1C(=O)C2=CC=CC=C2N=C1SCC(=O)NCCOC3=CC=CC=C3

Isomeric SMILES

COC(=O)CCN1C(=O)C2=CC=CC=C2N=C1SCC(=O)NCCOC3=CC=CC=C3

InChI

InChI=1S/C22H23N3O5S/c1-29-20(27)11-13-25-21(28)17-9-5-6-10-18(17)24-22(25)31-15-19(26)23-12-14-30-16-7-3-2-4-8-16/h2-10H,11-15H2,1H3,(H,23,26)