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

Systemtic Name: 2-[7-chloranyl-4-oxidanylidene-3-(3-propan-2-yloxypropyl)quinazolin-2-yl]sulfanyl-N-(2-methylpropylcarbamoyl)ethanamide Openeye Name: 2-[7-chloro-3-(3-isopropoxypropyl)-4-oxo-quinazolin-2-yl]sulfanyl-N-(isobutylcarbamoyl)acetamide CAS Name: 2-[[7-chloro-4-oxo-3-(3-propan-2-yloxypropyl)-2-quinazolinyl]thio]-N-[(2-methylpropylamino)-oxomethyl]acetamide IUPAC Name: 2-[7-chloro-4-oxo-3-(3-propan-2-yloxypropyl)quinazolin-2-yl]sulfanyl-N-(2-methylpropylcarbamoyl)acetamide Traditional Name: 2-[[7-chloro-3-(3-isopropoxypropyl)-4-keto-quinazolin-2-yl]thio]-N-(isobutylcarbamoyl)acetamide Formula: C21H29ClN4O4S MolecularWeight: 468.99736

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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)N1CCCOC(C)C

Isomeric SMILES

CC(C)CNC(=O)NC(=O)CSC1=NC2=C(C=CC(=C2)Cl)C(=O)N1CCCOC(C)C

InChI

InChI=1S/C21H29ClN4O4S/c1-13(2)11-23-20(29)25-18(27)12-31-21-24-17-10-15(22)6-7-16(17)19(28)26(21)8-5-9-30-14(3)4/h6-7,10,13-14H,5,8-9,11-12H2,1-4H3,(H2,23,25,27,29)