5-[(5-bromanylthiophen-2-yl)methylamino]-2,3-dihydrophthalazine-1,4-dione

Systemtic Name: 5-[(5-bromanylthiophen-2-yl)methylamino]-2,3-dihydrophthalazine-1,4-dione Openeye Name: 5-[(5-bromo-2-thienyl)methylamino]-2,3-dihydrophthalazine-1,4-dione CAS Name: 5-[(5-bromo-2-thiophenyl)methylamino]-2,3-dihydrophthalazine-1,4-dione IUPAC Name: 5-[(5-bromothiophen-2-yl)methylamino]-2,3-dihydrophthalazine-1,4-dione Traditional Name: 5-[(5-bromo-2-thienyl)methylamino]-2,3-dihydrophthalazine-1,4-quinone Formula: C13H10BrN3O2S MolecularWeight: 352.2064

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC2=C(C(=C1)NCC3=CC=C(S3)Br)C(=O)NNC2=O

Isomeric SMILES

C1=CC2=C(C(=C1)NCC3=CC=C(S3)Br)C(=O)NNC2=O

InChI

InChI=1S/C13H10BrN3O2S/c14-10-5-4-7(20-10)6-15-9-3-1-2-8-11(9)13(19)17-16-12(8)18/h1-5,15H,6H2,(H,16,18)(H,17,19)