ethyl 3-[2-(1H-benzo[f]benzimidazol-2-ylsulfanyl)ethanoylamino]benzoate

Systemtic Name: ethyl 3-[2-(1H-benzo[f]benzimidazol-2-ylsulfanyl)ethanoylamino]benzoate Openeye Name: ethyl 3-[[2-(1H-benzo[f]benzimidazol-2-ylsulfanyl)acetyl]amino]benzoate CAS Name: 3-[[2-(1H-benzo[f]benzimidazol-2-ylthio)-1-oxoethyl]amino]benzoic acid ethyl ester IUPAC Name: ethyl 3-[[2-(1H-benzo[f]benzimidazol-2-ylsulfanyl)acetyl]amino]benzoate Traditional Name: 3-[[2-(1H-benzo[f]benzimidazol-2-ylthio)acetyl]amino]benzoic acid ethyl ester Formula: C22H19N3O3S MolecularWeight: 405.46956

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=CC(=CC=C1)NC(=O)CSC2=NC3=CC4=CC=CC=C4C=C3N2

Isomeric SMILES

CCOC(=O)C1=CC(=CC=C1)NC(=O)CSC2=NC3=CC4=CC=CC=C4C=C3N2

InChI

InChI=1S/C22H19N3O3S/c1-2-28-21(27)16-8-5-9-17(10-16)23-20(26)13-29-22-24-18-11-14-6-3-4-7-15(14)12-19(18)25-22/h3-12H,2,13H2,1H3,(H,23,26)(H,24,25)