2-(7-chloranyl-4-oxidanylidene-3-propan-2-yl-quinazolin-2-yl)sulfanyl-N-(3-methylbutylcarbamoyl)ethanamide

Systemtic Name: 2-(7-chloranyl-4-oxidanylidene-3-propan-2-yl-quinazolin-2-yl)sulfanyl-N-(3-methylbutylcarbamoyl)ethanamide Openeye Name: 2-(7-chloro-3-isopropyl-4-oxo-quinazolin-2-yl)sulfanyl-N-(isopentylcarbamoyl)acetamide CAS Name: 2-[(7-chloro-4-oxo-3-propan-2-yl-2-quinazolinyl)thio]-N-[(3-methylbutylamino)-oxomethyl]acetamide IUPAC Name: 2-(7-chloro-4-oxo-3-propan-2-ylquinazolin-2-yl)sulfanyl-N-(3-methylbutylcarbamoyl)acetamide Traditional Name: 2-[(7-chloro-3-isopropyl-4-keto-quinazolin-2-yl)thio]-N-(isoamylcarbamoyl)acetamide Formula: C19H25ClN4O3S MolecularWeight: 424.9448

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CCNC(=O)NC(=O)CSC1=NC2=C(C=CC(=C2)Cl)C(=O)N1C(C)C

Isomeric SMILES

CC(C)CCNC(=O)NC(=O)CSC1=NC2=C(C=CC(=C2)Cl)C(=O)N1C(C)C

InChI

InChI=1S/C19H25ClN4O3S/c1-11(2)7-8-21-18(27)23-16(25)10-28-19-22-15-9-13(20)5-6-14(15)17(26)24(19)12(3)4/h5-6,9,11-12H,7-8,10H2,1-4H3,(H2,21,23,25,27)