2-[3-[(4-fluorophenyl)methyl]-4-oxidanylidene-quinazolin-2-yl]sulfanyl-N-(propan-2-ylcarbamoyl)ethanamide

Systemtic Name: 2-[3-[(4-fluorophenyl)methyl]-4-oxidanylidene-quinazolin-2-yl]sulfanyl-N-(propan-2-ylcarbamoyl)ethanamide Openeye Name: 2-[3-[(4-fluorophenyl)methyl]-4-oxo-quinazolin-2-yl]sulfanyl-N-(isopropylcarbamoyl)acetamide CAS Name: 2-[[3-[(4-fluorophenyl)methyl]-4-oxo-2-quinazolinyl]thio]-N-[oxo-(propan-2-ylamino)methyl]acetamide IUPAC Name: 2-[3-[(4-fluorophenyl)methyl]-4-oxoquinazolin-2-yl]sulfanyl-N-(propan-2-ylcarbamoyl)acetamide Traditional Name: 2-[[3-(4-fluorobenzyl)-4-keto-quinazolin-2-yl]thio]-N-(isopropylcarbamoyl)acetamide Formula: C21H21FN4O3S MolecularWeight: 428.479843

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)NC(=O)NC(=O)CSC1=NC2=CC=CC=C2C(=O)N1CC3=CC=C(C=C3)F

Isomeric SMILES

CC(C)NC(=O)NC(=O)CSC1=NC2=CC=CC=C2C(=O)N1CC3=CC=C(C=C3)F

InChI

InChI=1S/C21H21FN4O3S/c1-13(2)23-20(29)25-18(27)12-30-21-24-17-6-4-3-5-16(17)19(28)26(21)11-14-7-9-15(22)10-8-14/h3-10,13H,11-12H2,1-2H3,(H2,23,25,27,29)