methyl 2-[(3-chlorophenyl)methylsulfanyl]-3-(2-morpholin-4-ylethyl)-4-oxidanylidene-quinazoline-7-carboxylate

Systemtic Name: methyl 2-[(3-chlorophenyl)methylsulfanyl]-3-(2-morpholin-4-ylethyl)-4-oxidanylidene-quinazoline-7-carboxylate Openeye Name: methyl 2-[(3-chlorophenyl)methylsulfanyl]-3-(2-morpholinoethyl)-4-oxo-quinazoline-7-carboxylate CAS Name: 2-[(3-chlorophenyl)methylthio]-3-[2-(4-morpholinyl)ethyl]-4-oxo-7-quinazolinecarboxylic acid methyl ester IUPAC Name: methyl 2-[(3-chlorophenyl)methylsulfanyl]-3-(2-morpholin-4-ylethyl)-4-oxoquinazoline-7-carboxylate Traditional Name: 2-[(3-chlorobenzyl)thio]-4-keto-3-(2-morpholinoethyl)quinazoline-7-carboxylic acid methyl ester Formula: C23H24ClN3O4S MolecularWeight: 473.97236

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=CC2=C(C=C1)C(=O)N(C(=N2)SCC3=CC(=CC=C3)Cl)CCN4CCOCC4

Isomeric SMILES

COC(=O)C1=CC2=C(C=C1)C(=O)N(C(=N2)SCC3=CC(=CC=C3)Cl)CCN4CCOCC4

InChI

InChI=1S/C23H24ClN3O4S/c1-30-22(29)17-5-6-19-20(14-17)25-23(32-15-16-3-2-4-18(24)13-16)27(21(19)28)8-7-26-9-11-31-12-10-26/h2-6,13-14H,7-12,15H2,1H3