(E)-but-2-enedioic acid; 5-[1-(4-methylthiophen-3-yl)propyl]-1H-imidazole

Systemtic Name: (E)-but-2-enedioic acid; 5-[1-(4-methylthiophen-3-yl)propyl]-1H-imidazole Openeye Name: fumaric acid; 5-[1-(4-methyl-3-thienyl)propyl]-1H-imidazole CAS Name: (E)-2-butenedioic acid; 5-[1-(4-methyl-3-thiophenyl)propyl]-1H-imidazole IUPAC Name: (E)-but-2-enedioic acid; 5-[1-(4-methylthiophen-3-yl)propyl]-1H-imidazole Traditional Name: fumaric acid; 5-[1-(4-methyl-3-thienyl)propyl]-1H-imidazole Formula: C15H18N2O4S MolecularWeight: 322.37942

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C1=CN=CN1)C2=CSC=C2C.C(=CC(=O)O)C(=O)O

Isomeric SMILES

CCC(C1=CN=CN1)C2=CSC=C2C.C(=C/C(=O)O)\C(=O)O

InChI

InChI=1S/C11H14N2S.C4H4O4/c1-3-9(11-4-12-7-13-11)10-6-14-5-8(10)2;5-3(6)1-2-4(7)8/h4-7,9H,3H2,1-2H3,(H,12,13);1-2H,(H,5,6)(H,7,8)/b;2-1+