N-[(2R)-2-(5-bromanyl-2-oxidanyl-phenyl)-4-oxidanylidene-1,2-dihydroquinazolin-3-yl]benzamide

Systemtic Name: N-[(2R)-2-(5-bromanyl-2-oxidanyl-phenyl)-4-oxidanylidene-1,2-dihydroquinazolin-3-yl]benzamide Openeye Name: N-[(2R)-2-(5-bromo-2-hydroxy-phenyl)-4-oxo-1,2-dihydroquinazolin-3-yl]benzamide CAS Name: N-[(2R)-2-(5-bromo-2-hydroxyphenyl)-4-oxo-1,2-dihydroquinazolin-3-yl]benzamide IUPAC Name: N-[(2R)-2-(5-bromo-2-hydroxyphenyl)-4-oxo-1,2-dihydroquinazolin-3-yl]benzamide Traditional Name: N-[(2R)-2-(5-bromo-2-hydroxy-phenyl)-4-keto-1,2-dihydroquinazolin-3-yl]benzamide Formula: C21H16BrN3O3 MolecularWeight: 438.27404

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C(=O)NN2C(NC3=CC=CC=C3C2=O)C4=C(C=CC(=C4)Br)O

Isomeric SMILES

C1=CC=C(C=C1)C(=O)NN2[C@@H](NC3=CC=CC=C3C2=O)C4=C(C=CC(=C4)Br)O

InChI

InChI=1S/C21H16BrN3O3/c22-14-10-11-18(26)16(12-14)19-23-17-9-5-4-8-15(17)21(28)25(19)24-20(27)13-6-2-1-3-7-13/h1-12,19,23,26H,(H,24,27)/t19-/m1/s1