2-[(2E)-2-[(6-bromanyl-1,3-benzodioxol-5-yl)methylidene]hydrazinyl]-1H-quinazolin-4-one

Systemtic Name: 2-[(2E)-2-[(6-bromanyl-1,3-benzodioxol-5-yl)methylidene]hydrazinyl]-1H-quinazolin-4-one Openeye Name: 2-[(2E)-2-[(6-bromo-1,3-benzodioxol-5-yl)methylene]hydrazino]-1H-quinazolin-4-one CAS Name: 2-[(2E)-2-[(6-bromo-1,3-benzodioxol-5-yl)methylidene]hydrazinyl]-1H-quinazolin-4-one IUPAC Name: 2-[(2E)-2-[(6-bromo-1,3-benzodioxol-5-yl)methylidene]hydrazinyl]-1H-quinazolin-4-one Traditional Name: 2-[(N'E)-N'-[(6-bromo-1,3-benzodioxol-5-yl)methylene]hydrazino]-1H-quinazolin-4-one Formula: C16H11BrN4O3 MolecularWeight: 387.18754

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Descriptors Computed from Structure

Canonical SMILES:

C1OC2=C(O1)C=C(C(=C2)C=NNC3=NC(=O)C4=CC=CC=C4N3)Br

Isomeric SMILES

C1OC2=C(O1)C=C(C(=C2)/C=N/NC3=NC(=O)C4=CC=CC=C4N3)Br

InChI

InChI=1S/C16H11BrN4O3/c17-11-6-14-13(23-8-24-14)5-9(11)7-18-21-16-19-12-4-2-1-3-10(12)15(22)20-16/h1-7H,8H2,(H2,19,20,21,22)/b18-7+