2-(6-bromanyl-4-oxidanylidene-3-phenyl-quinazolin-2-yl)sulfanyl-N-cyclopentyl-ethanamide

Systemtic Name: 2-(6-bromanyl-4-oxidanylidene-3-phenyl-quinazolin-2-yl)sulfanyl-N-cyclopentyl-ethanamide Openeye Name: 2-(6-bromo-4-oxo-3-phenyl-quinazolin-2-yl)sulfanyl-N-cyclopentyl-acetamide CAS Name: 2-[(6-bromo-4-oxo-3-phenyl-2-quinazolinyl)thio]-N-cyclopentylacetamide IUPAC Name: 2-(6-bromo-4-oxo-3-phenylquinazolin-2-yl)sulfanyl-N-cyclopentylacetamide Traditional Name: 2-[(6-bromo-4-keto-3-phenyl-quinazolin-2-yl)thio]-N-cyclopentyl-acetamide Formula: C21H20BrN3O2S MolecularWeight: 458.3714

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(C1)NC(=O)CSC2=NC3=C(C=C(C=C3)Br)C(=O)N2C4=CC=CC=C4

Isomeric SMILES

C1CCC(C1)NC(=O)CSC2=NC3=C(C=C(C=C3)Br)C(=O)N2C4=CC=CC=C4

InChI

InChI=1S/C21H20BrN3O2S/c22-14-10-11-18-17(12-14)20(27)25(16-8-2-1-3-9-16)21(24-18)28-13-19(26)23-15-6-4-5-7-15/h1-3,8-12,15H,4-7,13H2,(H,23,26)