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

Systemtic Name: 2-[7-chloranyl-4-oxidanylidene-3-(oxolan-2-ylmethyl)quinazolin-2-yl]sulfanyl-N-(3-ethoxypropylcarbamoyl)ethanamide Openeye Name: 2-[7-chloro-4-oxo-3-(tetrahydrofuran-2-ylmethyl)quinazolin-2-yl]sulfanyl-N-(3-ethoxypropylcarbamoyl)acetamide CAS Name: 2-[[7-chloro-4-oxo-3-(2-oxolanylmethyl)-2-quinazolinyl]thio]-N-[(3-ethoxypropylamino)-oxomethyl]acetamide IUPAC Name: 2-[7-chloro-4-oxo-3-(oxolan-2-ylmethyl)quinazolin-2-yl]sulfanyl-N-(3-ethoxypropylcarbamoyl)acetamide Traditional Name: 2-[[7-chloro-4-keto-3-(tetrahydrofurfuryl)quinazolin-2-yl]thio]-N-(3-ethoxypropylcarbamoyl)acetamide Formula: C21H27ClN4O5S MolecularWeight: 482.98088

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C21H27ClN4O5S/c1-2-30-9-4-8-23-20(29)25-18(27)13-32-21-24-17-11-14(22)6-7-16(17)19(28)26(21)12-15-5-3-10-31-15/h6-7,11,15H,2-5,8-10,12-13H2,1H3,(H2,23,25,27,29)