methyl 2-[2-(2-methylmorpholin-4-yl)-2-oxidanylidene-ethyl]sulfanyl-4-oxidanylidene-3-phenethyl-quinazoline-7-carboxylate

Systemtic Name: methyl 2-[2-(2-methylmorpholin-4-yl)-2-oxidanylidene-ethyl]sulfanyl-4-oxidanylidene-3-phenethyl-quinazoline-7-carboxylate Openeye Name: methyl 2-[2-(2-methylmorpholin-4-yl)-2-oxo-ethyl]sulfanyl-4-oxo-3-phenethyl-quinazoline-7-carboxylate CAS Name: 2-[[2-(2-methyl-4-morpholinyl)-2-oxoethyl]thio]-4-oxo-3-phenethyl-7-quinazolinecarboxylic acid methyl ester IUPAC Name: methyl 2-[2-(2-methylmorpholin-4-yl)-2-oxoethyl]sulfanyl-4-oxo-3-phenethylquinazoline-7-carboxylate Traditional Name: 4-keto-2-[[2-keto-2-(2-methylmorpholino)ethyl]thio]-3-phenethyl-quinazoline-7-carboxylic acid methyl ester Formula: C25H27N3O5S MolecularWeight: 481.56398

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Descriptors Computed from Structure

Canonical SMILES:

CC1CN(CCO1)C(=O)CSC2=NC3=C(C=CC(=C3)C(=O)OC)C(=O)N2CCC4=CC=CC=C4

Isomeric SMILES

CC1CN(CCO1)C(=O)CSC2=NC3=C(C=CC(=C3)C(=O)OC)C(=O)N2CCC4=CC=CC=C4

InChI

InChI=1S/C25H27N3O5S/c1-17-15-27(12-13-33-17)22(29)16-34-25-26-21-14-19(24(31)32-2)8-9-20(21)23(30)28(25)11-10-18-6-4-3-5-7-18/h3-9,14,17H,10-13,15-16H2,1-2H3