(E)-N-(6-iodanyl-4-oxidanylidene-2-thiophen-2-yl-quinazolin-3-yl)-3-phenyl-prop-2-enamide

Systemtic Name: (E)-N-(6-iodanyl-4-oxidanylidene-2-thiophen-2-yl-quinazolin-3-yl)-3-phenyl-prop-2-enamide Openeye Name: (E)-N-[6-iodo-4-oxo-2-(2-thienyl)quinazolin-3-yl]-3-phenyl-prop-2-enamide CAS Name: (E)-N-(6-iodo-4-oxo-2-thiophen-2-yl-3-quinazolinyl)-3-phenyl-2-propenamide IUPAC Name: (E)-N-(6-iodo-4-oxo-2-thiophen-2-ylquinazolin-3-yl)-3-phenylprop-2-enamide Traditional Name: (E)-N-[6-iodo-4-keto-2-(2-thienyl)quinazolin-3-yl]-3-phenyl-acrylamide Formula: C21H14IN3O2S MolecularWeight: 499.32423

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C=CC(=O)NN2C(=NC3=C(C2=O)C=C(C=C3)I)C4=CC=CS4

Isomeric SMILES

C1=CC=C(C=C1)/C=C/C(=O)NN2C(=NC3=C(C2=O)C=C(C=C3)I)C4=CC=CS4

InChI

InChI=1S/C21H14IN3O2S/c22-15-9-10-17-16(13-15)21(27)25(20(23-17)18-7-4-12-28-18)24-19(26)11-8-14-5-2-1-3-6-14/h1-13H,(H,24,26)/b11-8+