2-[3-[2-(4-fluorophenyl)ethyl]-4-oxidanylidene-quinazolin-2-yl]sulfanyl-N-(2-methoxyphenyl)ethanamide

Systemtic Name: 2-[3-[2-(4-fluorophenyl)ethyl]-4-oxidanylidene-quinazolin-2-yl]sulfanyl-N-(2-methoxyphenyl)ethanamide Openeye Name: 2-[3-[2-(4-fluorophenyl)ethyl]-4-oxo-quinazolin-2-yl]sulfanyl-N-(2-methoxyphenyl)acetamide CAS Name: 2-[[3-[2-(4-fluorophenyl)ethyl]-4-oxo-2-quinazolinyl]thio]-N-(2-methoxyphenyl)acetamide IUPAC Name: 2-[3-[2-(4-fluorophenyl)ethyl]-4-oxoquinazolin-2-yl]sulfanyl-N-(2-methoxyphenyl)acetamide Traditional Name: 2-[[3-[2-(4-fluorophenyl)ethyl]-4-keto-quinazolin-2-yl]thio]-N-(2-methoxyphenyl)acetamide Formula: C25H22FN3O3S MolecularWeight: 463.523883

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC=C1NC(=O)CSC2=NC3=CC=CC=C3C(=O)N2CCC4=CC=C(C=C4)F

Isomeric SMILES

COC1=CC=CC=C1NC(=O)CSC2=NC3=CC=CC=C3C(=O)N2CCC4=CC=C(C=C4)F

InChI

InChI=1S/C25H22FN3O3S/c1-32-22-9-5-4-8-21(22)27-23(30)16-33-25-28-20-7-3-2-6-19(20)24(31)29(25)15-14-17-10-12-18(26)13-11-17/h2-13H,14-16H2,1H3,(H,27,30)