5-[2-[(6-ethoxy-1H-benzimidazol-2-yl)sulfanyl]ethanoylamino]-2-oxidanyl-benzoate

Systemtic Name: 5-[2-[(6-ethoxy-1H-benzimidazol-2-yl)sulfanyl]ethanoylamino]-2-oxidanyl-benzoate Openeye Name: 5-[[2-[(6-ethoxy-1H-benzimidazol-2-yl)sulfanyl]acetyl]amino]-2-hydroxy-benzoate CAS Name: 5-[[2-[(6-ethoxy-1H-benzimidazol-2-yl)thio]-1-oxoethyl]amino]-2-hydroxybenzoate IUPAC Name: 5-[[2-[(6-ethoxy-1H-benzimidazol-2-yl)sulfanyl]acetyl]amino]-2-hydroxybenzoate Traditional Name: 5-[[2-[(6-ethoxy-1H-benzimidazol-2-yl)thio]acetyl]amino]-2-hydroxy-benzoate Formula: C18H16N3O5S- MolecularWeight: 386.40174

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC2=C(C=C1)N=C(N2)SCC(=O)NC3=CC(=C(C=C3)O)C(=O)[O-]

Isomeric SMILES

CCOC1=CC2=C(C=C1)N=C(N2)SCC(=O)NC3=CC(=C(C=C3)O)C(=O)[O-]

InChI

InChI=1S/C18H17N3O5S/c1-2-26-11-4-5-13-14(8-11)21-18(20-13)27-9-16(23)19-10-3-6-15(22)12(7-10)17(24)25/h3-8,22H,2,9H2,1H3,(H,19,23)(H,20,21)(H,24,25)/p-1