2-[6-chloranyl-3-(2-methylpropyl)-4-oxidanylidene-quinazolin-2-yl]sulfanyl-N-(3-methylbutylcarbamoyl)ethanamide

Systemtic Name: 2-[6-chloranyl-3-(2-methylpropyl)-4-oxidanylidene-quinazolin-2-yl]sulfanyl-N-(3-methylbutylcarbamoyl)ethanamide Openeye Name: 2-(6-chloro-3-isobutyl-4-oxo-quinazolin-2-yl)sulfanyl-N-(isopentylcarbamoyl)acetamide CAS Name: 2-[[6-chloro-3-(2-methylpropyl)-4-oxo-2-quinazolinyl]thio]-N-[(3-methylbutylamino)-oxomethyl]acetamide IUPAC Name: 2-[6-chloro-3-(2-methylpropyl)-4-oxoquinazolin-2-yl]sulfanyl-N-(3-methylbutylcarbamoyl)acetamide Traditional Name: 2-[(6-chloro-3-isobutyl-4-keto-quinazolin-2-yl)thio]-N-(isoamylcarbamoyl)acetamide Formula: C20H27ClN4O3S MolecularWeight: 438.97138

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CCNC(=O)NC(=O)CSC1=NC2=C(C=C(C=C2)Cl)C(=O)N1CC(C)C

Isomeric SMILES

CC(C)CCNC(=O)NC(=O)CSC1=NC2=C(C=C(C=C2)Cl)C(=O)N1CC(C)C

InChI

InChI=1S/C20H27ClN4O3S/c1-12(2)7-8-22-19(28)24-17(26)11-29-20-23-16-6-5-14(21)9-15(16)18(27)25(20)10-13(3)4/h5-6,9,12-13H,7-8,10-11H2,1-4H3,(H2,22,24,26,28)