(E)-but-2-enedioic acid; 1-(4,5-dihydro-1H-imidazol-2-yl)-3-(2-ethyl-6-methyl-phenyl)urea

Systemtic Name: (E)-but-2-enedioic acid; 1-(4,5-dihydro-1H-imidazol-2-yl)-3-(2-ethyl-6-methyl-phenyl)urea Openeye Name: 1-(4,5-dihydro-1H-imidazol-2-yl)-3-(2-ethyl-6-methyl-phenyl)urea; fumaric acid CAS Name: (E)-2-butenedioic acid; 1-(4,5-dihydro-1H-imidazol-2-yl)-3-(2-ethyl-6-methylphenyl)urea IUPAC Name: (E)-but-2-enedioic acid; 1-(4,5-dihydro-1H-imidazol-2-yl)-3-(2-ethyl-6-methylphenyl)urea Traditional Name: 1-(2-ethyl-6-methyl-phenyl)-3-(2-imidazolin-2-yl)urea; fumaric acid Formula: C17H22N4O5 MolecularWeight: 362.38038

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC=CC(=C1NC(=O)NC2=NCCN2)C.C(=CC(=O)O)C(=O)O

Isomeric SMILES

CCC1=CC=CC(=C1NC(=O)NC2=NCCN2)C.C(=C/C(=O)O)\C(=O)O

InChI

InChI=1S/C13H18N4O.C4H4O4/c1-3-10-6-4-5-9(2)11(10)16-13(18)17-12-14-7-8-15-12;5-3(6)1-2-4(7)8/h4-6H,3,7-8H2,1-2H3,(H3,14,15,16,17,18);1-2H,(H,5,6)(H,7,8)/b;2-1+