2-[1-(2-acetamidoethyl)benzimidazol-2-yl]sulfanylethanoic acid

Systemtic Name: 2-[1-(2-acetamidoethyl)benzimidazol-2-yl]sulfanylethanoic acid Openeye Name: 2-[1-(2-acetamidoethyl)benzimidazol-2-yl]sulfanylacetic acid CAS Name: 2-[[1-(2-acetamidoethyl)-2-benzimidazolyl]thio]acetic acid IUPAC Name: 2-[1-(2-acetamidoethyl)benzimidazol-2-yl]sulfanylacetic acid Traditional Name: 2-[[1-(2-acetamidoethyl)benzimidazol-2-yl]thio]acetic acid Formula: C13H15N3O3S MolecularWeight: 293.3415

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)NCCN1C2=CC=CC=C2N=C1SCC(=O)O

Isomeric SMILES

CC(=O)NCCN1C2=CC=CC=C2N=C1SCC(=O)O

InChI

InChI=1S/C13H15N3O3S/c1-9(17)14-6-7-16-11-5-3-2-4-10(11)15-13(16)20-8-12(18)19/h2-5H,6-8H2,1H3,(H,14,17)(H,18,19)