ethanedioic acid; 2-[(2-methyl-1-benzothiophen-3-yl)methyl]-4,5-dihydro-1H-imidazole

Systemtic Name: ethanedioic acid; 2-[(2-methyl-1-benzothiophen-3-yl)methyl]-4,5-dihydro-1H-imidazole Openeye Name: 2-[(2-methylbenzothiophen-3-yl)methyl]-4,5-dihydro-1H-imidazole; oxalic acid CAS Name: 2-[(2-methyl-1-benzothiophen-3-yl)methyl]-4,5-dihydro-1H-imidazole; oxalic acid IUPAC Name: 2-[(2-methyl-1-benzothiophen-3-yl)methyl]-4,5-dihydro-1H-imidazole; oxalic acid Traditional Name: 2-[(2-methylbenzothiophen-3-yl)methyl]-2-imidazoline; oxalic acid Formula: C15H16N2O4S MolecularWeight: 320.36354

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C2=CC=CC=C2S1)CC3=NCCN3.C(=O)(C(=O)O)O

Isomeric SMILES

CC1=C(C2=CC=CC=C2S1)CC3=NCCN3.C(=O)(C(=O)O)O

InChI

InChI=1S/C13H14N2S.C2H2O4/c1-9-11(8-13-14-6-7-15-13)10-4-2-3-5-12(10)16-9;3-1(4)2(5)6/h2-5H,6-8H2,1H3,(H,14,15);(H,3,4)(H,5,6)