3-[(6-methyl-1H-benzimidazol-2-yl)sulfanyl]-2-oxidanylidene-propanoic acid

Systemtic Name: 3-[(6-methyl-1H-benzimidazol-2-yl)sulfanyl]-2-oxidanylidene-propanoic acid Openeye Name: 3-[(6-methyl-1H-benzimidazol-2-yl)sulfanyl]-2-oxo-propanoic acid CAS Name: 3-[(6-methyl-1H-benzimidazol-2-yl)thio]-2-oxopropanoic acid IUPAC Name: 3-[(6-methyl-1H-benzimidazol-2-yl)sulfanyl]-2-oxopropanoic acid Traditional Name: 2-keto-3-[(6-methyl-1H-benzimidazol-2-yl)thio]propionic acid Formula: C11H10N2O3S MolecularWeight: 250.2737

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC2=C(C=C1)N=C(N2)SCC(=O)C(=O)O

Isomeric SMILES

CC1=CC2=C(C=C1)N=C(N2)SCC(=O)C(=O)O

InChI

InChI=1S/C11H10N2O3S/c1-6-2-3-7-8(4-6)13-11(12-7)17-5-9(14)10(15)16/h2-4H,5H2,1H3,(H,12,13)(H,15,16)