2-(7-chloranyl-4-oxidanylidene-3-pentyl-quinazolin-2-yl)sulfanyl-N-(2-methylpropylcarbamoyl)ethanamide

Systemtic Name: 2-(7-chloranyl-4-oxidanylidene-3-pentyl-quinazolin-2-yl)sulfanyl-N-(2-methylpropylcarbamoyl)ethanamide Openeye Name: 2-(7-chloro-4-oxo-3-pentyl-quinazolin-2-yl)sulfanyl-N-(isobutylcarbamoyl)acetamide CAS Name: 2-[(7-chloro-4-oxo-3-pentyl-2-quinazolinyl)thio]-N-[(2-methylpropylamino)-oxomethyl]acetamide IUPAC Name: 2-(7-chloro-4-oxo-3-pentylquinazolin-2-yl)sulfanyl-N-(2-methylpropylcarbamoyl)acetamide Traditional Name: 2-[(3-amyl-7-chloro-4-keto-quinazolin-2-yl)thio]-N-(isobutylcarbamoyl)acetamide Formula: C20H27ClN4O3S MolecularWeight: 438.97138

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCN1C(=O)C2=C(C=C(C=C2)Cl)N=C1SCC(=O)NC(=O)NCC(C)C

Isomeric SMILES

CCCCCN1C(=O)C2=C(C=C(C=C2)Cl)N=C1SCC(=O)NC(=O)NCC(C)C

InChI

InChI=1S/C20H27ClN4O3S/c1-4-5-6-9-25-18(27)15-8-7-14(21)10-16(15)23-20(25)29-12-17(26)24-19(28)22-11-13(2)3/h7-8,10,13H,4-6,9,11-12H2,1-3H3,(H2,22,24,26,28)