2-[3,5-bis(bromanyl)-4-morpholin-4-ylsulfonyl-phenyl]-1,2,4-triazine-3,5-dione

Systemtic Name: 2-[3,5-bis(bromanyl)-4-morpholin-4-ylsulfonyl-phenyl]-1,2,4-triazine-3,5-dione Openeye Name: 2-(3,5-dibromo-4-morpholinosulfonyl-phenyl)-1,2,4-triazine-3,5-dione CAS Name: 2-[3,5-dibromo-4-(4-morpholinylsulfonyl)phenyl]-1,2,4-triazine-3,5-dione IUPAC Name: 2-(3,5-dibromo-4-morpholin-4-ylsulfonylphenyl)-1,2,4-triazine-3,5-dione Traditional Name: 2-(3,5-dibromo-4-morpholinosulfonyl-phenyl)-1,2,4-triazine-3,5-quinone Formula: C13H12Br2N4O5S MolecularWeight: 496.13118

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Descriptors Computed from Structure

Canonical SMILES:

C1COCCN1S(=O)(=O)C2=C(C=C(C=C2Br)N3C(=O)NC(=O)C=N3)Br

Isomeric SMILES

C1COCCN1S(=O)(=O)C2=C(C=C(C=C2Br)N3C(=O)NC(=O)C=N3)Br

InChI

InChI=1S/C13H12Br2N4O5S/c14-9-5-8(19-13(21)17-11(20)7-16-19)6-10(15)12(9)25(22,23)18-1-3-24-4-2-18/h5-7H,1-4H2,(H,17,20,21)