2-(6-bromanyl-3-ethyl-4-oxidanylidene-quinazolin-2-yl)sulfanyl-N-(4-ethylphenyl)propanamide

Systemtic Name: 2-(6-bromanyl-3-ethyl-4-oxidanylidene-quinazolin-2-yl)sulfanyl-N-(4-ethylphenyl)propanamide Openeye Name: 2-(6-bromo-3-ethyl-4-oxo-quinazolin-2-yl)sulfanyl-N-(4-ethylphenyl)propanamide CAS Name: 2-[(6-bromo-3-ethyl-4-oxo-2-quinazolinyl)thio]-N-(4-ethylphenyl)propanamide IUPAC Name: 2-(6-bromo-3-ethyl-4-oxoquinazolin-2-yl)sulfanyl-N-(4-ethylphenyl)propanamide Traditional Name: 2-[(6-bromo-3-ethyl-4-keto-quinazolin-2-yl)thio]-N-(4-ethylphenyl)propionamide Formula: C21H22BrN3O2S MolecularWeight: 460.38728

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC=C(C=C1)NC(=O)C(C)SC2=NC3=C(C=C(C=C3)Br)C(=O)N2CC

Isomeric SMILES

CCC1=CC=C(C=C1)NC(=O)C(C)SC2=NC3=C(C=C(C=C3)Br)C(=O)N2CC

InChI

InChI=1S/C21H22BrN3O2S/c1-4-14-6-9-16(10-7-14)23-19(26)13(3)28-21-24-18-11-8-15(22)12-17(18)20(27)25(21)5-2/h6-13H,4-5H2,1-3H3,(H,23,26)