(E)-but-2-enedioate; 5-[methoxy-(4-methylthiophen-3-yl)methyl]-1H-imidazole

Systemtic Name: (E)-but-2-enedioate; 5-[methoxy-(4-methylthiophen-3-yl)methyl]-1H-imidazole Openeye Name: (E)-but-2-enedioate; 5-[methoxy-(4-methyl-3-thienyl)methyl]-1H-imidazole CAS Name: (E)-2-butenedioate; 5-[methoxy-(4-methyl-3-thiophenyl)methyl]-1H-imidazole IUPAC Name: (E)-but-2-enedioate; 5-[methoxy-(4-methylthiophen-3-yl)methyl]-1H-imidazole Traditional Name: 5-[methoxy-(4-methyl-3-thienyl)methyl]-1H-imidazole fumarate Formula: C14H14N2O5S-2 MolecularWeight: 322.33636

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CSC=C1C(C2=CN=CN2)OC.C(=CC(=O)[O-])C(=O)[O-]

Isomeric SMILES

CC1=CSC=C1C(C2=CN=CN2)OC.C(=C/C(=O)[O-])\C(=O)[O-]

InChI

InChI=1S/C10H12N2OS.C4H4O4/c1-7-4-14-5-8(7)10(13-2)9-3-11-6-12-9;5-3(6)1-2-4(7)8/h3-6,10H,1-2H3,(H,11,12);1-2H,(H,5,6)(H,7,8)/p-2/b;2-1+