5-[3,4-bis(bromanyl)thiophen-2-yl]-2-methyl-1H-imidazole; (E)-but-2-enedioic acid

Systemtic Name: 5-[3,4-bis(bromanyl)thiophen-2-yl]-2-methyl-1H-imidazole; (E)-but-2-enedioic acid Openeye Name: 5-(3,4-dibromo-2-thienyl)-2-methyl-1H-imidazole; fumaric acid CAS Name: (E)-2-butenedioic acid; 5-(3,4-dibromo-2-thiophenyl)-2-methyl-1H-imidazole IUPAC Name: (E)-but-2-enedioic acid; 5-(3,4-dibromothiophen-2-yl)-2-methyl-1H-imidazole Traditional Name: 5-(3,4-dibromo-2-thienyl)-2-methyl-1H-imidazole; fumaric acid Formula: C12H10Br2N2O4S MolecularWeight: 438.0918

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC=C(N1)C2=C(C(=CS2)Br)Br.C(=CC(=O)O)C(=O)O

Isomeric SMILES

CC1=NC=C(N1)C2=C(C(=CS2)Br)Br.C(=C/C(=O)O)\C(=O)O

InChI

InChI=1S/C8H6Br2N2S.C4H4O4/c1-4-11-2-6(12-4)8-7(10)5(9)3-13-8;5-3(6)1-2-4(7)8/h2-3H,1H3,(H,11,12);1-2H,(H,5,6)(H,7,8)/b;2-1+