methyl 2-(2-ethoxyethylsulfanyl)-4-oxidanylidene-3-phenethyl-quinazoline-7-carboxylate

Systemtic Name: methyl 2-(2-ethoxyethylsulfanyl)-4-oxidanylidene-3-phenethyl-quinazoline-7-carboxylate Openeye Name: methyl 2-(2-ethoxyethylsulfanyl)-4-oxo-3-phenethyl-quinazoline-7-carboxylate CAS Name: 2-(2-ethoxyethylthio)-4-oxo-3-phenethyl-7-quinazolinecarboxylic acid methyl ester IUPAC Name: methyl 2-(2-ethoxyethylsulfanyl)-4-oxo-3-phenethylquinazoline-7-carboxylate Traditional Name: 2-(2-ethoxyethylthio)-4-keto-3-phenethyl-quinazoline-7-carboxylic acid methyl ester Formula: C22H24N2O4S MolecularWeight: 412.50196

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Descriptors Computed from Structure

Canonical SMILES:

CCOCCSC1=NC2=C(C=CC(=C2)C(=O)OC)C(=O)N1CCC3=CC=CC=C3

Isomeric SMILES

CCOCCSC1=NC2=C(C=CC(=C2)C(=O)OC)C(=O)N1CCC3=CC=CC=C3

InChI

InChI=1S/C22H24N2O4S/c1-3-28-13-14-29-22-23-19-15-17(21(26)27-2)9-10-18(19)20(25)24(22)12-11-16-7-5-4-6-8-16/h4-10,15H,3,11-14H2,1-2H3