N-[4-[(3-chloranyl-4-fluoranyl-phenyl)amino]quinazolin-6-yl]-2H-1,2,3-triazole-4-carboxamide

Systemtic Name: N-[4-[(3-chloranyl-4-fluoranyl-phenyl)amino]quinazolin-6-yl]-2H-1,2,3-triazole-4-carboxamide Openeye Name: N-[4-(3-chloro-4-fluoro-anilino)quinazolin-6-yl]-2H-triazole-4-carboxamide CAS Name: N-[4-(3-chloro-4-fluoroanilino)-6-quinazolinyl]-2H-triazole-4-carboxamide IUPAC Name: N-[4-(3-chloro-4-fluoroanilino)quinazolin-6-yl]-2H-triazole-4-carboxamide Traditional Name: N-[4-(3-chloro-4-fluoro-anilino)quinazolin-6-yl]-2H-triazole-4-carboxamide Formula: C17H11ClFN7O MolecularWeight: 383.766943

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC2=C(C=C1NC(=O)C3=NNN=C3)C(=NC=N2)NC4=CC(=C(C=C4)F)Cl

Isomeric SMILES

C1=CC2=C(C=C1NC(=O)C3=NNN=C3)C(=NC=N2)NC4=CC(=C(C=C4)F)Cl

InChI

InChI=1S/C17H11ClFN7O/c18-12-6-10(1-3-13(12)19)23-16-11-5-9(2-4-14(11)20-8-21-16)24-17(27)15-7-22-26-25-15/h1-8H,(H,24,27)(H,20,21,23)(H,22,25,26)