3-(2-chloranyl-4-iodanyl-phenyl)-5-(1,4-dihydroquinazolin-2-yl)-2-ethenyl-6-fluoranyl-4-oxidanylidene-pyridine-3-carbonitrile

Systemtic Name: 3-(2-chloranyl-4-iodanyl-phenyl)-5-(1,4-dihydroquinazolin-2-yl)-2-ethenyl-6-fluoranyl-4-oxidanylidene-pyridine-3-carbonitrile Openeye Name: 3-(2-chloro-4-iodo-phenyl)-5-(1,4-dihydroquinazolin-2-yl)-6-fluoro-4-oxo-2-vinyl-pyridine-3-carbonitrile CAS Name: 3-(2-chloro-4-iodophenyl)-5-(1,4-dihydroquinazolin-2-yl)-2-ethenyl-6-fluoro-4-oxo-3-pyridinecarbonitrile IUPAC Name: 3-(2-chloro-4-iodophenyl)-5-(1,4-dihydroquinazolin-2-yl)-2-ethenyl-6-fluoro-4-oxopyridine-3-carbonitrile Traditional Name: 3-(2-chloro-4-iodo-phenyl)-5-(1,4-dihydroquinazolin-2-yl)-6-fluoro-4-keto-2-vinyl-nicotinonitrile Formula: C22H13ClFIN4O MolecularWeight: 530.720693

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Descriptors Computed from Structure

Canonical SMILES:

C=CC1=NC(=C(C(=O)C1(C#N)C2=C(C=C(C=C2)I)Cl)C3=NCC4=CC=CC=C4N3)F

Isomeric SMILES

C=CC1=NC(=C(C(=O)C1(C#N)C2=C(C=C(C=C2)I)Cl)C3=NCC4=CC=CC=C4N3)F

InChI

InChI=1S/C22H13ClFIN4O/c1-2-17-22(11-26,14-8-7-13(25)9-15(14)23)19(30)18(20(24)29-17)21-27-10-12-5-3-4-6-16(12)28-21/h2-9H,1,10H2,(H,27,28)