3-[(3-bromophenyl)methyl]-4-oxidanylidene-2-sulfanylidene-N-[4-(trifluoromethyloxy)phenyl]-1H-quinazoline-7-carboxamide

Systemtic Name: 3-[(3-bromophenyl)methyl]-4-oxidanylidene-2-sulfanylidene-N-[4-(trifluoromethyloxy)phenyl]-1H-quinazoline-7-carboxamide Openeye Name: 3-[(3-bromophenyl)methyl]-4-oxo-2-thioxo-N-[4-(trifluoromethoxy)phenyl]-1H-quinazoline-7-carboxamide CAS Name: 3-[(3-bromophenyl)methyl]-4-oxo-2-sulfanylidene-N-[4-(trifluoromethoxy)phenyl]-1H-quinazoline-7-carboxamide IUPAC Name: 3-[(3-bromophenyl)methyl]-4-oxo-2-sulfanylidene-N-[4-(trifluoromethoxy)phenyl]-1H-quinazoline-7-carboxamide Traditional Name: 3-(3-bromobenzyl)-4-keto-2-thioxo-N-[4-(trifluoromethoxy)phenyl]-1H-quinazoline-7-carboxamide Formula: C23H15BrF3N3O3S MolecularWeight: 550.34771

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC(=C1)Br)CN2C(=O)C3=C(C=C(C=C3)C(=O)NC4=CC=C(C=C4)OC(F)(F)F)NC2=S

Isomeric SMILES

C1=CC(=CC(=C1)Br)CN2C(=O)C3=C(C=C(C=C3)C(=O)NC4=CC=C(C=C4)OC(F)(F)F)NC2=S

InChI

InChI=1S/C23H15BrF3N3O3S/c24-15-3-1-2-13(10-15)12-30-21(32)18-9-4-14(11-19(18)29-22(30)34)20(31)28-16-5-7-17(8-6-16)33-23(25,26)27/h1-11H,12H2,(H,28,31)(H,29,34)