N-[(2R)-2-(1,3-benzodioxol-5-yl)-6-bromanyl-4-oxidanylidene-1,2-dihydroquinazolin-3-yl]pyridine-4-carboxamide

Systemtic Name: N-[(2R)-2-(1,3-benzodioxol-5-yl)-6-bromanyl-4-oxidanylidene-1,2-dihydroquinazolin-3-yl]pyridine-4-carboxamide Openeye Name: N-[(2R)-2-(1,3-benzodioxol-5-yl)-6-bromo-4-oxo-1,2-dihydroquinazolin-3-yl]pyridine-4-carboxamide CAS Name: N-[(2R)-2-(1,3-benzodioxol-5-yl)-6-bromo-4-oxo-1,2-dihydroquinazolin-3-yl]-4-pyridinecarboxamide IUPAC Name: N-[(2R)-2-(1,3-benzodioxol-5-yl)-6-bromo-4-oxo-1,2-dihydroquinazolin-3-yl]pyridine-4-carboxamide Traditional Name: N-[(2R)-2-(1,3-benzodioxol-5-yl)-6-bromo-4-keto-1,2-dihydroquinazolin-3-yl]isonicotinamide Formula: C21H15BrN4O4 MolecularWeight: 467.2722

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Descriptors Computed from Structure

Canonical SMILES:

C1OC2=C(O1)C=C(C=C2)C3NC4=C(C=C(C=C4)Br)C(=O)N3NC(=O)C5=CC=NC=C5

Isomeric SMILES

C1OC2=C(O1)C=C(C=C2)[C@@H]3NC4=C(C=C(C=C4)Br)C(=O)N3NC(=O)C5=CC=NC=C5

InChI

InChI=1S/C21H15BrN4O4/c22-14-2-3-16-15(10-14)21(28)26(25-20(27)12-5-7-23-8-6-12)19(24-16)13-1-4-17-18(9-13)30-11-29-17/h1-10,19,24H,11H2,(H,25,27)/t19-/m1/s1