2-[7-chloranyl-3-(3-methylbutyl)-4-oxidanylidene-quinazolin-2-yl]sulfanyl-N-[(4-fluorophenyl)methyl]-N-methyl-ethanamide

Systemtic Name: 2-[7-chloranyl-3-(3-methylbutyl)-4-oxidanylidene-quinazolin-2-yl]sulfanyl-N-[(4-fluorophenyl)methyl]-N-methyl-ethanamide Openeye Name: 2-(7-chloro-3-isopentyl-4-oxo-quinazolin-2-yl)sulfanyl-N-[(4-fluorophenyl)methyl]-N-methyl-acetamide CAS Name: 2-[[7-chloro-3-(3-methylbutyl)-4-oxo-2-quinazolinyl]thio]-N-[(4-fluorophenyl)methyl]-N-methylacetamide IUPAC Name: 2-[7-chloro-3-(3-methylbutyl)-4-oxoquinazolin-2-yl]sulfanyl-N-[(4-fluorophenyl)methyl]-N-methylacetamide Traditional Name: 2-[(7-chloro-3-isoamyl-4-keto-quinazolin-2-yl)thio]-N-(4-fluorobenzyl)-N-methyl-acetamide Formula: C23H25ClFN3O2S MolecularWeight: 461.979903

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CCN1C(=O)C2=C(C=C(C=C2)Cl)N=C1SCC(=O)N(C)CC3=CC=C(C=C3)F

Isomeric SMILES

CC(C)CCN1C(=O)C2=C(C=C(C=C2)Cl)N=C1SCC(=O)N(C)CC3=CC=C(C=C3)F

InChI

InChI=1S/C23H25ClFN3O2S/c1-15(2)10-11-28-22(30)19-9-6-17(24)12-20(19)26-23(28)31-14-21(29)27(3)13-16-4-7-18(25)8-5-16/h4-9,12,15H,10-11,13-14H2,1-3H3