2-[(2-fluorophenyl)methylsulfanyl]-N-(2-methoxyethyl)-3-(4-methoxyphenyl)-4-oxidanylidene-quinazoline-7-carboxamide

Systemtic Name: 2-[(2-fluorophenyl)methylsulfanyl]-N-(2-methoxyethyl)-3-(4-methoxyphenyl)-4-oxidanylidene-quinazoline-7-carboxamide Openeye Name: 2-[(2-fluorophenyl)methylsulfanyl]-N-(2-methoxyethyl)-3-(4-methoxyphenyl)-4-oxo-quinazoline-7-carboxamide CAS Name: 2-[(2-fluorophenyl)methylthio]-N-(2-methoxyethyl)-3-(4-methoxyphenyl)-4-oxo-7-quinazolinecarboxamide IUPAC Name: 2-[(2-fluorophenyl)methylsulfanyl]-N-(2-methoxyethyl)-3-(4-methoxyphenyl)-4-oxoquinazoline-7-carboxamide Traditional Name: 2-[(2-fluorobenzyl)thio]-4-keto-N-(2-methoxyethyl)-3-(4-methoxyphenyl)quinazoline-7-carboxamide Formula: C26H24FN3O4S MolecularWeight: 493.549863

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Descriptors Computed from Structure

Canonical SMILES:

COCCNC(=O)C1=CC2=C(C=C1)C(=O)N(C(=N2)SCC3=CC=CC=C3F)C4=CC=C(C=C4)OC

Isomeric SMILES

COCCNC(=O)C1=CC2=C(C=C1)C(=O)N(C(=N2)SCC3=CC=CC=C3F)C4=CC=C(C=C4)OC

InChI

InChI=1S/C26H24FN3O4S/c1-33-14-13-28-24(31)17-7-12-21-23(15-17)29-26(35-16-18-5-3-4-6-22(18)27)30(25(21)32)19-8-10-20(34-2)11-9-19/h3-12,15H,13-14,16H2,1-2H3,(H,28,31)