2-[7-chloranyl-4-oxidanylidene-3-(oxolan-2-ylmethyl)quinazolin-2-yl]sulfanyl-N-(2-methylpropylcarbamoyl)ethanamide

Systemtic Name: 2-[7-chloranyl-4-oxidanylidene-3-(oxolan-2-ylmethyl)quinazolin-2-yl]sulfanyl-N-(2-methylpropylcarbamoyl)ethanamide Openeye Name: 2-[7-chloro-4-oxo-3-(tetrahydrofuran-2-ylmethyl)quinazolin-2-yl]sulfanyl-N-(isobutylcarbamoyl)acetamide CAS Name: 2-[[7-chloro-4-oxo-3-(2-oxolanylmethyl)-2-quinazolinyl]thio]-N-[(2-methylpropylamino)-oxomethyl]acetamide IUPAC Name: 2-[7-chloro-4-oxo-3-(oxolan-2-ylmethyl)quinazolin-2-yl]sulfanyl-N-(2-methylpropylcarbamoyl)acetamide Traditional Name: 2-[[7-chloro-4-keto-3-(tetrahydrofurfuryl)quinazolin-2-yl]thio]-N-(isobutylcarbamoyl)acetamide Formula: C20H25ClN4O4S MolecularWeight: 452.9549

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CNC(=O)NC(=O)CSC1=NC2=C(C=CC(=C2)Cl)C(=O)N1CC3CCCO3

Isomeric SMILES

CC(C)CNC(=O)NC(=O)CSC1=NC2=C(C=CC(=C2)Cl)C(=O)N1CC3CCCO3

InChI

InChI=1S/C20H25ClN4O4S/c1-12(2)9-22-19(28)24-17(26)11-30-20-23-16-8-13(21)5-6-15(16)18(27)25(20)10-14-4-3-7-29-14/h5-6,8,12,14H,3-4,7,9-11H2,1-2H3,(H2,22,24,26,28)