2-[2-[(5,6-dimethyl-1H-benzimidazol-2-yl)sulfanyl]ethanoylamino]ethanoic acid

Systemtic Name: 2-[2-[(5,6-dimethyl-1H-benzimidazol-2-yl)sulfanyl]ethanoylamino]ethanoic acid Openeye Name: 2-[[2-[(5,6-dimethyl-1H-benzimidazol-2-yl)sulfanyl]acetyl]amino]acetic acid CAS Name: 2-[[2-[(5,6-dimethyl-1H-benzimidazol-2-yl)thio]-1-oxoethyl]amino]acetic acid IUPAC Name: 2-[[2-[(5,6-dimethyl-1H-benzimidazol-2-yl)sulfanyl]acetyl]amino]acetic acid Traditional Name: 2-[[2-[(5,6-dimethyl-1H-benzimidazol-2-yl)thio]acetyl]amino]acetic acid Formula: C13H15N3O3S MolecularWeight: 293.3415

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC2=C(C=C1C)N=C(N2)SCC(=O)NCC(=O)O

Isomeric SMILES

CC1=CC2=C(C=C1C)N=C(N2)SCC(=O)NCC(=O)O

InChI

InChI=1S/C13H15N3O3S/c1-7-3-9-10(4-8(7)2)16-13(15-9)20-6-11(17)14-5-12(18)19/h3-4H,5-6H2,1-2H3,(H,14,17)(H,15,16)(H,18,19)