2-(6-bromanyl-4-oxidanylidene-3-pentyl-quinazolin-2-yl)sulfanyl-N-(2,5-dimethylpyrazol-3-yl)ethanamide

Systemtic Name: 2-(6-bromanyl-4-oxidanylidene-3-pentyl-quinazolin-2-yl)sulfanyl-N-(2,5-dimethylpyrazol-3-yl)ethanamide Openeye Name: 2-(6-bromo-4-oxo-3-pentyl-quinazolin-2-yl)sulfanyl-N-(2,5-dimethylpyrazol-3-yl)acetamide CAS Name: 2-[(6-bromo-4-oxo-3-pentyl-2-quinazolinyl)thio]-N-(2,5-dimethyl-3-pyrazolyl)acetamide IUPAC Name: 2-(6-bromo-4-oxo-3-pentylquinazolin-2-yl)sulfanyl-N-(2,5-dimethylpyrazol-3-yl)acetamide Traditional Name: 2-[(3-amyl-6-bromo-4-keto-quinazolin-2-yl)thio]-N-(2,5-dimethylpyrazol-3-yl)acetamide Formula: C20H24BrN5O2S MolecularWeight: 478.40586

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCN1C(=O)C2=C(C=CC(=C2)Br)N=C1SCC(=O)NC3=CC(=NN3C)C

Isomeric SMILES

CCCCCN1C(=O)C2=C(C=CC(=C2)Br)N=C1SCC(=O)NC3=CC(=NN3C)C

InChI

InChI=1S/C20H24BrN5O2S/c1-4-5-6-9-26-19(28)15-11-14(21)7-8-16(15)22-20(26)29-12-18(27)23-17-10-13(2)24-25(17)3/h7-8,10-11H,4-6,9,12H2,1-3H3,(H,23,27)